N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide

C15H22N2O — CID 54963386

IUPACN-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide
SMILESCc1ccc(C(C)NCC(=O)NCC2CC2)cc1
InChIInChI=1S/C15H22N2O/c1-11-3-7-14(8-4-11)12(2)16-10-15(18)17-9-13-5-6-13/h3-4,7-8,12-13,16H,5-6,9-10H2,1-2H3,(H,17,18)
InChIKeyJKXGQCBVSOMFCV-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.17
Rot. Bonds6

About N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide

N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide (PubChem CID 54963386) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide
PubChem CID54963386
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide
SMILESCc1ccc(C(C)NCC(=O)NCC2CC2)cc1
InChIInChI=1S/C15H22N2O/c1-11-3-7-14(8-4-11)12(2)16-10-15(18)17-9-13-5-6-13/h3-4,7-8,12-13,16H,5-6,9-10H2,1-2H3,(H,17,18)
InChIKeyJKXGQCBVSOMFCV-UHFFFAOYSA-N
XLogP2.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-2-[[(1R)-1-(4-fluorophenyl)ethyl]amino]acetamide
CID 81348477
2-(cyclopropylmethylamino)-N-[1-(4-methylphenyl)ethyl]acetamide;hydrochloride
CID 119705801
N-(cyclopropylmethyl)-2-[[(1R)-1-(3-fluorophenyl)ethyl]amino]acetamide
CID 81365357
N-(cyanomethyl)-2-[[(1R)-1-(4-methylphenyl)ethyl]amino]acetamide
CID 81356886
N-(cyclopropylmethyl)-2-[[(1R)-1-(3-methoxyphenyl)ethyl]amino]acetamide
CID 81373337
1-(4-methylphenyl)-N-(thian-4-ylmethyl)ethanamine
CID 115720001
N-(cyclopropylmethyl)-2-[[2-methyl-1-(4-propylphenyl)propyl]amino]acetamide
CID 78841972
N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 43567877
2-[[(1S)-1-(4-bromo-2-fluorophenyl)ethyl]amino]-N-(cyclopropylmethyl)acetamide
CID 99626334
1-(cyclopropylmethyl)-3-[4-[1-(ethylamino)ethyl]phenyl]urea
CID 61341452
N-[(4-ethylcyclohexyl)methyl]-2-(propan-2-ylamino)acetamide
CID 54880897
2-(cyclopropylmethylamino)-2-(4-methylphenyl)ethanol
CID 61056447

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide (CID 54963386) is N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide is Cc1ccc(C(C)NCC(=O)NCC2CC2)cc1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide?
The InChIKey is JKXGQCBVSOMFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11-3-7-14(8-4-11)12(2)16-10-15(18)17-9-13-5-6-13/h3-4,7-8,12-13,16H,5-6,9-10H2,1-2H3,(H,17,18).
What are the key properties of N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide?
N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide has a molecular weight of 246.35 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[1-(4-methylphenyl)ethylamino]acetamide is sourced from PubChem (CID 54963386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).