(4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide

C15H27N5O — CID 125441014

IUPAC(4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide
SMILESC[C@H](CCC(=O)NCCc1ccn[nH]1)N1CCN(C)CC1
InChIInChI=1S/C15H27N5O/c1-13(20-11-9-19(2)10-12-20)3-4-15(21)16-7-5-14-6-8-17-18-14/h6,8,13H,3-5,7,9-12H2,1-2H3,(H,16,21)(H,17,18)/t13-/m1/s1
InChIKeyBJWVSNJTYHZNOB-CYBMUJFWSA-N
MW293.41 g/mol
LogP0.48
Rot. Bonds7

About (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide

(4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide (PubChem CID 125441014) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide.

Molecular Properties

Compound Name(4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide
PubChem CID125441014
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC Name(4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide
SMILESC[C@H](CCC(=O)NCCc1ccn[nH]1)N1CCN(C)CC1
InChIInChI=1S/C15H27N5O/c1-13(20-11-9-19(2)10-12-20)3-4-15(21)16-7-5-14-6-8-17-18-14/h6,8,13H,3-5,7,9-12H2,1-2H3,(H,16,21)(H,17,18)/t13-/m1/s1
InChIKeyBJWVSNJTYHZNOB-CYBMUJFWSA-N
XLogP0.48
TPSA64.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-methylpiperazin-1-yl)-N-[2-(5-methylthiophen-2-yl)ethyl]pentanamide
CID 91764415
N-[3-(4,5-dimethyl-1,3-thiazol-2-yl)propyl]-4-(4-methylpiperazin-1-yl)pentanamide
CID 91833958
2-ethoxy-N-[(3R)-3-(4-methylpiperazin-1-yl)butyl]acetamide
CID 125435468
N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide
CID 170982015
(3S)-3-(4-acetyl-3,5-dimethylpyrazol-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]butanamide
CID 125166393
(4R)-4-pyrrolidin-1-yl-N-[3-(1,3-thiazol-2-yl)propyl]pentanamide
CID 126452069
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-4-(4-methylpiperazin-1-yl)pentanamide
CID 118786717
5-[(1R)-1-piperidin-1-ylethyl]-N-[2-(1H-pyrazol-5-yl)ethyl]furan-2-carboxamide
CID 125448711
N-[(3R)-3-(4-methylpiperazin-1-yl)butyl]-2-methylsulfanylacetamide
CID 125443769
2-(2,2-difluorocyclopropyl)-N-[2-(1H-pyrazol-5-yl)ethyl]acetamide
CID 122562469
N-methyl-5-[[[(4R)-4-(4-methylpiperazin-1-yl)pentanoyl]amino]methyl]furan-2-carboxamide
CID 125163780
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(4-methylpiperazin-1-yl)pentanamide
CID 91836065

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide?
The IUPAC name of (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide (CID 125441014) is (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide.
What is the SMILES notation for (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide?
The canonical SMILES for (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide is C[C@H](CCC(=O)NCCc1ccn[nH]1)N1CCN(C)CC1.
What is the InChIKey of (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide?
The InChIKey is BJWVSNJTYHZNOB-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H27N5O/c1-13(20-11-9-19(2)10-12-20)3-4-15(21)16-7-5-14-6-8-17-18-14/h6,8,13H,3-5,7,9-12H2,1-2H3,(H,16,21)(H,17,18)/t13-/m1/s1.
What are the key properties of (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide?
(4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide has a molecular weight of 293.41 g/mol, XLogP of 0.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide is sourced from PubChem (CID 125441014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).