N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide

C14H17N5O — CID 63641722

IUPACN-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide
SMILESO=C(CNCc1n[nH]nc1-c1ccccc1)NC1CC1
InChIInChI=1S/C14H17N5O/c20-13(16-11-6-7-11)9-15-8-12-14(18-19-17-12)10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H,16,20)(H,17,18,19)
InChIKeyYXWYUGNAJWWWEZ-UHFFFAOYSA-N
MW271.32 g/mol
LogP0.84
Rot. Bonds6

About N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide

N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide (PubChem CID 63641722) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide
PubChem CID63641722
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide
SMILESO=C(CNCc1n[nH]nc1-c1ccccc1)NC1CC1
InChIInChI=1S/C14H17N5O/c20-13(16-11-6-7-11)9-15-8-12-14(18-19-17-12)10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H,16,20)(H,17,18,19)
InChIKeyYXWYUGNAJWWWEZ-UHFFFAOYSA-N
XLogP0.84
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-phenyl-2H-triazol-4-yl)methyl]cyclopent-3-en-1-amine
CID 113475085
2-(benzylamino)-N-cyclohexylacetamide
CID 19163991
6-[(5-phenyl-2H-triazol-4-yl)methylamino]hexan-1-ol
CID 107848714
N-cyclopropyl-2-(quinolin-2-ylmethylamino)acetamide
CID 43401916
N-cyclopropyl-3-(1-methyl-3-phenylpyrazol-4-yl)propanamide
CID 53033035
cyclopropyl-(5-phenyl-2H-triazol-4-yl)methanone
CID 138981933
1,1-dimethyl-3-[1-(5-phenyl-2H-triazole-4-carbonyl)piperidin-4-yl]urea
CID 166254505
1-(4-methylphenyl)-N-[(5-phenyl-2H-triazol-4-yl)methyl]methanamine
CID 63641898
N-cyclopropyl-3-(4,5-diphenylimidazol-1-yl)propanamide
CID 110436229
3-[[[2-(cyclopropylamino)-2-oxoethyl]amino]methyl]benzoic acid
CID 103239145
N-cyclopropyl-2-phenylacetamide
CID 5175687
N-(4-methylcyclohexyl)-2-(3-phenylindazol-1-yl)acetamide
CID 20877585

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide (CID 63641722) is N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide is O=C(CNCc1n[nH]nc1-c1ccccc1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide?
The InChIKey is YXWYUGNAJWWWEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c20-13(16-11-6-7-11)9-15-8-12-14(18-19-17-12)10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H,16,20)(H,17,18,19).
What are the key properties of N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide?
N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide has a molecular weight of 271.32 g/mol, XLogP of 0.84, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(5-phenyl-2H-triazol-4-yl)methylamino]acetamide is sourced from PubChem (CID 63641722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).