1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide

C9H14N4O2 — CID 138053930

IUPAC1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide
SMILESCOC1(C(=O)Nc2cn[nH]n2)CCCC1
InChIInChI=1S/C9H14N4O2/c1-15-9(4-2-3-5-9)8(14)11-7-6-10-13-12-7/h6H,2-5H2,1H3,(H2,10,11,12,13,14)
InChIKeyGMDPHNSFWOLWPG-UHFFFAOYSA-N
MW210.24 g/mol
LogP0.70
Rot. Bonds3

About 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide

1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide (PubChem CID 138053930) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide
PubChem CID138053930
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide
SMILESCOC1(C(=O)Nc2cn[nH]n2)CCCC1
InChIInChI=1S/C9H14N4O2/c1-15-9(4-2-3-5-9)8(14)11-7-6-10-13-12-7/h6H,2-5H2,1H3,(H2,10,11,12,13,14)
InChIKeyGMDPHNSFWOLWPG-UHFFFAOYSA-N
XLogP0.70
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2H-triazol-4-ylamino)cyclohexane-1-carboxylic acid
CID 175520419
N-(6-butoxy-3-pyridinyl)-1-methoxycyclopentane-1-carboxamide
CID 100775055
ethane;1-methoxy-N-sulfanylcyclohexane-1-carboxamide
CID 171543267
N-[4-(2-amino-2-oxoethoxy)phenyl]-1-methoxycyclohexane-1-carboxamide
CID 99822465
N-(4-butoxyphenyl)-1-methoxycyclohexane-1-carboxamide
CID 100703561
4-methoxy-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]oxane-4-carboxamide
CID 167767001
4-[(1-methoxycycloheptanecarbonyl)amino]thiophene-2-carboxamide
CID 138053626
trans-(1R,2R)-2-(4-methoxyphenyl)-N-(2H-triazol-4-yl)cyclopropane-1-carboxamide
CID 138027191
2-methoxy-1-(1-methoxycyclopentyl)ethanone
CID 104610256
N-(6-butoxy-2-methyl-3-pyridinyl)-1-methoxycycloheptane-1-carboxamide
CID 100775270
4-methoxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]piperidine-4-carboxamide;hydrochloride
CID 119728728
1-methoxy-N-[8-(2-methylpropoxy)quinolin-5-yl]cyclopentane-1-carboxamide
CID 100775150

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide (CID 138053930) is 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide is COC1(C(=O)Nc2cn[nH]n2)CCCC1.
What is the InChIKey of 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide?
The InChIKey is GMDPHNSFWOLWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-15-9(4-2-3-5-9)8(14)11-7-6-10-13-12-7/h6H,2-5H2,1H3,(H2,10,11,12,13,14).
What are the key properties of 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide?
1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide has a molecular weight of 210.24 g/mol, XLogP of 0.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-(2H-triazol-4-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 138053930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).