1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide

C12H20N4O — CID 114140497

IUPAC1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide
SMILESCc1c(CNC(=O)C2(N)CCCC2)cnn1C
InChIInChI=1S/C12H20N4O/c1-9-10(8-15-16(9)2)7-14-11(17)12(13)5-3-4-6-12/h8H,3-7,13H2,1-2H3,(H,14,17)
InChIKeyQNGGXGXESYZKMB-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.62
Rot. Bonds3

About 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide

1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide (PubChem CID 114140497) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide
PubChem CID114140497
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide
SMILESCc1c(CNC(=O)C2(N)CCCC2)cnn1C
InChIInChI=1S/C12H20N4O/c1-9-10(8-15-16(9)2)7-14-11(17)12(13)5-3-4-6-12/h8H,3-7,13H2,1-2H3,(H,14,17)
InChIKeyQNGGXGXESYZKMB-UHFFFAOYSA-N
XLogP0.62
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-carbamothioyl-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide
CID 106035310
N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(trifluoromethyl)cyclopentane-1-carboxamide
CID 126816544
1-[2-[(1,5-dimethylpyrazol-4-yl)methylamino]-2-oxoethyl]cyclobutane-1-carboxylic acid
CID 120550042
N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-ethylpiperidine-4-carboxamide
CID 106047304
N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-methyl-3-methylidenecyclobutane-1-carboxamide
CID 126840448
tert-butyl 1-[(1,5-dimethylpyrazol-4-yl)methylcarbamoyl]cyclobutane-1-carboxylate
CID 126822697
1-amino-N-[(2-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide
CID 63302989
2-[(1,5-dimethylpyrazol-4-yl)methylamino]ethylurea
CID 83110053
N-(2-aminoethyl)-N'-[(1,5-dimethylpyrazol-4-yl)methyl]oxamide
CID 106033656
(1,5-dimethylpyrazol-4-yl)methylthiourea
CID 106032933
2-[(1,5-dimethylpyrazol-4-yl)methylcarbamoylamino]oxyacetic acid
CID 106037417
1-[4-(aminomethyl)phenyl]-3-[(1,5-dimethylpyrazol-4-yl)methyl]urea
CID 106049514

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide (CID 114140497) is 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide is Cc1c(CNC(=O)C2(N)CCCC2)cnn1C.
What is the InChIKey of 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide?
The InChIKey is QNGGXGXESYZKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9-10(8-15-16(9)2)7-14-11(17)12(13)5-3-4-6-12/h8H,3-7,13H2,1-2H3,(H,14,17).
What are the key properties of 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide?
1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 114140497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).