1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide

C16H20N4O — CID 79646407

IUPAC1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(n2cc(-c3ccccc3)cn2)C1
InChIInChI=1S/C16H20N4O/c1-18-16(15(17)21)8-7-14(9-16)20-11-13(10-19-20)12-5-3-2-4-6-12/h2-6,10-11,14,18H,7-9H2,1H3,(H2,17,21)
InChIKeyLZVVDJIAEOXGEE-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.72
Rot. Bonds4

About 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide

1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide (PubChem CID 79646407) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide
PubChem CID79646407
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(n2cc(-c3ccccc3)cn2)C1
InChIInChI=1S/C16H20N4O/c1-18-16(15(17)21)8-7-14(9-16)20-11-13(10-19-20)12-5-3-2-4-6-12/h2-6,10-11,14,18H,7-9H2,1H3,(H2,17,21)
InChIKeyLZVVDJIAEOXGEE-UHFFFAOYSA-N
XLogP1.72
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentyl]methanol
CID 79647766
3-(4-iodopyrazol-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 79638137
3-(4-chloro-3-methylpyrazol-1-yl)-1-(methylamino)cyclopentane-1-carboxamide
CID 79649186
3-(4-chloropyrazol-1-yl)-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79651397
1-(cyclopropylamino)-3-(4-iodopyrazol-1-yl)cyclopentane-1-carboxamide
CID 79648337
3-(4-bromopyrazol-1-yl)-1-(cyclopropylamino)cyclopentane-1-carboxamide
CID 79651042
3-(4-chloropyrazol-1-yl)-1-(propan-2-ylamino)cyclopentane-1-carboxylic acid
CID 79651468
3-(4-iodopyrazol-1-yl)-1-(methylamino)cyclohexane-1-carboxylic acid
CID 79637304
1-(cyclopropylamino)-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentane-1-carboxamide
CID 79646419
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxamide
CID 79651474
ethyl 1-(methylamino)-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentane-1-carboxylate
CID 79646418
3-(4-phenylpyrazol-1-yl)cyclopentan-1-ol
CID 79632343

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide (CID 79646407) is 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide is CNC1(C(N)=O)CCC(n2cc(-c3ccccc3)cn2)C1.
What is the InChIKey of 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide?
The InChIKey is LZVVDJIAEOXGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-18-16(15(17)21)8-7-14(9-16)20-11-13(10-19-20)12-5-3-2-4-6-12/h2-6,10-11,14,18H,7-9H2,1H3,(H2,17,21).
What are the key properties of 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide?
1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 1.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-3-(4-phenylpyrazol-1-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 79646407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).