2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide

C13H18N2O — CID 28566911

IUPAC2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNCC2CC2)cc1
InChIInChI=1S/C13H18N2O/c1-10-2-6-12(7-3-10)15-13(16)9-14-8-11-4-5-11/h2-3,6-7,11,14H,4-5,8-9H2,1H3,(H,15,16)
InChIKeyUCYFOZDRMDJDEI-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.93
Rot. Bonds5

About 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide

2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide (PubChem CID 28566911) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
PubChem CID28566911
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNCC2CC2)cc1
InChIInChI=1S/C13H18N2O/c1-10-2-6-12(7-3-10)15-13(16)9-14-8-11-4-5-11/h2-3,6-7,11,14H,4-5,8-9H2,1H3,(H,15,16)
InChIKeyUCYFOZDRMDJDEI-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]carbamate
CID 60866405
2-(cyclopropylmethylamino)-N-(4-methylsulfanylphenyl)acetamide;hydrochloride
CID 119694268
4-[[2-(cyclopropylmethylamino)acetyl]amino]-N-methylbenzamide
CID 60868348
N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]cyclopropanecarboxamide;hydrochloride
CID 119700150
N-(4-fluorophenyl)-2-[(4-methylcyclohexyl)methylamino]acetamide
CID 63243623
2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide
CID 64911376
2-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-N-(4-methylphenyl)acetamide
CID 60975482
2-(cyclopropylmethylamino)-N-(3,4-dimethylphenyl)acetamide;hydrochloride
CID 119670640
N-[4-[(4-chlorophenyl)carbamoylamino]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119752578
4-[[2-(cyclopropylmethylamino)acetyl]amino]benzamide;hydrochloride
CID 119672411
2-(cyclopropylmethylamino)-N-(4-propoxyphenyl)acetamide
CID 55060300
N-(4-bromophenyl)-2-[(4-hydroxycyclohexyl)methylamino]acetamide
CID 106133833

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide (CID 28566911) is 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)CNCC2CC2)cc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide?
The InChIKey is UCYFOZDRMDJDEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-10-2-6-12(7-3-10)15-13(16)9-14-8-11-4-5-11/h2-3,6-7,11,14H,4-5,8-9H2,1H3,(H,15,16).
What are the key properties of 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide?
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide has a molecular weight of 218.30 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 28566911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).