(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide

C15H27N5O — CID 103813844

IUPAC(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide
SMILESCCN(CC)CCn1cc(NC(=O)[C@@H]2CCCCN2)cn1
InChIInChI=1S/C15H27N5O/c1-3-19(4-2)9-10-20-12-13(11-17-20)18-15(21)14-7-5-6-8-16-14/h11-12,14,16H,3-10H2,1-2H3,(H,18,21)/t14-/m0/s1
InChIKeyFFBSZAYNRSPJHZ-AWEZNQCLSA-N
MW293.41 g/mol
LogP1.31
Rot. Bonds7

About (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide

(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide (PubChem CID 103813844) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide
PubChem CID103813844
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC Name(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide
SMILESCCN(CC)CCn1cc(NC(=O)[C@@H]2CCCCN2)cn1
InChIInChI=1S/C15H27N5O/c1-3-19(4-2)9-10-20-12-13(11-17-20)18-15(21)14-7-5-6-8-16-14/h11-12,14,16H,3-10H2,1-2H3,(H,18,21)/t14-/m0/s1
InChIKeyFFBSZAYNRSPJHZ-AWEZNQCLSA-N
XLogP1.31
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61163094
(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119292192
N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-3-carboxamide
CID 60945562
(2S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61179722
2-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]cyclopentane-1-carboxamide
CID 64823183
(2S)-N-(1-benzylpyrazol-4-yl)piperidine-2-carboxamide;hydrochloride
CID 119740026
N-[1-[2-(cyclopentylamino)-2-oxoethyl]pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 119309124
N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]butanamide
CID 47927357
2-chloro-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]acetamide
CID 54867250
1-amino-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]cyclopentane-1-carboxamide
CID 60945429
N-[3-(diethylamino)propyl]azepane-2-carboxamide
CID 64563964
(2S)-N-(1-propan-2-ylpyrazol-4-yl)pyrrolidine-2-carboxamide
CID 62902493

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide?
The IUPAC name of (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide (CID 103813844) is (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide.
What is the SMILES notation for (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide?
The canonical SMILES for (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide is CCN(CC)CCn1cc(NC(=O)[C@@H]2CCCCN2)cn1.
What is the InChIKey of (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide?
The InChIKey is FFBSZAYNRSPJHZ-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H27N5O/c1-3-19(4-2)9-10-20-12-13(11-17-20)18-15(21)14-7-5-6-8-16-14/h11-12,14,16H,3-10H2,1-2H3,(H,18,21)/t14-/m0/s1.
What are the key properties of (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide?
(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide has a molecular weight of 293.41 g/mol, XLogP of 1.31, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide is sourced from PubChem (CID 103813844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).