N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide

C19H24ClN5O2 — CID 146047738

IUPACN-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide
SMILESO=C(N[C@H]1CCOC1Cc1cnccc1-n1cc(Cl)cn1)C1CCNCC1
InChIInChI=1S/C19H24ClN5O2/c20-15-11-23-25(12-15)17-3-7-22-10-14(17)9-18-16(4-8-27-18)24-19(26)13-1-5-21-6-2-13/h3,7,10-13,16,18,21H,1-2,4-6,8-9H2,(H,24,26)/t16-,18?/m0/s1
InChIKeySENAXRWMKDKRTM-ATNAJCNCSA-N
MW389.89 g/mol
LogP1.74
Rot. Bonds5

About N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide

N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide (PubChem CID 146047738) has the molecular formula C19H24ClN5O2 and a molecular weight of 389.89 g/mol. Its IUPAC name is N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide
PubChem CID146047738
Molecular FormulaC19H24ClN5O2
Molecular Weight389.89 g/mol
Exact Mass389.16
IUPAC NameN-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide
SMILESO=C(N[C@H]1CCOC1Cc1cnccc1-n1cc(Cl)cn1)C1CCNCC1
InChIInChI=1S/C19H24ClN5O2/c20-15-11-23-25(12-15)17-3-7-22-10-14(17)9-18-16(4-8-27-18)24-19(26)13-1-5-21-6-2-13/h3,7,10-13,16,18,21H,1-2,4-6,8-9H2,(H,24,26)/t16-,18?/m0/s1
InChIKeySENAXRWMKDKRTM-ATNAJCNCSA-N
XLogP1.74
TPSA81.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.89
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

US9963443, Reference Example 14
CID 118450653
2-(1H-pyrazol-1-yl)-N-(pyridin-3-yl(tetrahydro-2H-pyran-4-yl)methyl)propanamide
CID 91629822
1-(4-(4-chloro-1H-pyrazol-1-yl)pyridin-3-yl)-N-methyl-N-((3S)-tetrahydrofuran-3-yl)piperidine-4-carboxamide
CID 118450485
1-[4-(4-chloropyrazol-1-yl)-3-pyridinyl]-N-(oxan-4-yl)piperidine-4-carboxamide
CID 118450767
2-[(3S)-4-[3-(4-chloropyrazol-1-yl)propanoyl]morpholin-3-yl]-N-(pyridin-4-ylmethyl)acetamide
CID 95867607
(2S,3S)-N-[2-(2-methyl-3-pyridinyl)ethyl]-3-(pyrazol-1-ylmethyl)oxolane-2-carboxamide
CID 164639070
N-[(3S)-2-(2-fluoroethyl)-2-[4-(4-methylpyrazol-1-yl)-3-pyridinyl]oxolan-3-yl]piperidine-4-carboxamide
CID 140868402
4-chloro-1-methyl-N-[4-(pyridin-4-ylmethyl)oxolan-3-yl]pyrazole-3-carboxamide
CID 168452684
1-(4-(4-methyl-1H-pyrazol-1-yl)pyridin-3-yl)-N-((3S)-tetrahydrofuran-3-yl)piperidine-4-carboxamide
CID 118450428
1-(4-(4-chloro-1H-pyrazol-1-yl)pyridin-3-yl)-N-((3R)-tetrahydrofuran-3-yl)piperidine-4-carboxamide
CID 118450483
1-(4-(4-methyl-1H-pyrazol-1-yl)pyridin-3-yl)-N-((3R)-tetrahydrofuran-3-yl)piperidine-4-carboxamide
CID 118450506
(2R,4R)-1-[4-[4-(4-chloropyrazol-1-yl)-3-pyridinyl]piperidine-4-carbonyl]-4-methoxypyrrolidine-2-carbonitrile
CID 118450529

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide?
The IUPAC name of N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide (CID 146047738) is N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide.
What is the SMILES notation for N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide?
The canonical SMILES for N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide is O=C(N[C@H]1CCOC1Cc1cnccc1-n1cc(Cl)cn1)C1CCNCC1.
What is the InChIKey of N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide?
The InChIKey is SENAXRWMKDKRTM-ATNAJCNCSA-N. The full InChI is InChI=1S/C19H24ClN5O2/c20-15-11-23-25(12-15)17-3-7-22-10-14(17)9-18-16(4-8-27-18)24-19(26)13-1-5-21-6-2-13/h3,7,10-13,16,18,21H,1-2,4-6,8-9H2,(H,24,26)/t16-,18?/m0/s1.
What are the key properties of N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide?
N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide has a molecular weight of 389.89 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-2-[[4-(4-chloropyrazol-1-yl)-3-pyridinyl]methyl]oxolan-3-yl]piperidine-4-carboxamide is sourced from PubChem (CID 146047738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).