N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide

C18H27N3O — CID 119899295

IUPACN-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide
SMILESCN(c1ccccc1NC(=O)CNCC1CC1)C1CCCC1
InChIInChI=1S/C18H27N3O/c1-21(15-6-2-3-7-15)17-9-5-4-8-16(17)20-18(22)13-19-12-14-10-11-14/h4-5,8-9,14-15,19H,2-3,6-7,10-13H2,1H3,(H,20,22)
InChIKeyCVKLSGQTXGYCHI-UHFFFAOYSA-N
MW301.43 g/mol
LogP3.00
Rot. Bonds7

About N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide

N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide (PubChem CID 119899295) has the molecular formula C18H27N3O and a molecular weight of 301.43 g/mol. Its IUPAC name is N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide.

Molecular Properties

Compound NameN-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide
PubChem CID119899295
Molecular FormulaC18H27N3O
Molecular Weight301.43 g/mol
Exact Mass301.22
IUPAC NameN-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide
SMILESCN(c1ccccc1NC(=O)CNCC1CC1)C1CCCC1
InChIInChI=1S/C18H27N3O/c1-21(15-6-2-3-7-15)17-9-5-4-8-16(17)20-18(22)13-19-12-14-10-11-14/h4-5,8-9,14-15,19H,2-3,6-7,10-13H2,1H3,(H,20,22)
InChIKeyCVKLSGQTXGYCHI-UHFFFAOYSA-N
XLogP3.00
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide
CID 119899319
4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]-3-methoxybutanamide
CID 120597455
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 60867454
N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide
CID 110015008
2-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]propanamide;dihydrochloride
CID 119899288
2-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]pentanamide
CID 119899281
2-(cyclohexylmethylamino)-N-(2-fluorophenyl)acetamide
CID 43215446
2-(cyclopentylamino)-N-[2-(dimethylamino)phenyl]acetamide
CID 60849441
2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide
CID 71849650
4-[[2-[cyclopentyl(methyl)amino]phenyl]carbamoylamino]butanoic acid
CID 122086913
3-[2-[cyclopentyl(methyl)amino]phenyl]-1-methyl-1-[[(3R)-oxolan-3-yl]methyl]urea
CID 97061195
2-(cyclopropylmethylamino)-N-(2-phenylphenyl)acetamide;hydrochloride
CID 119675331

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide?
The IUPAC name of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide (CID 119899295) is N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide.
What is the SMILES notation for N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide?
The canonical SMILES for N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide is CN(c1ccccc1NC(=O)CNCC1CC1)C1CCCC1.
What is the InChIKey of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide?
The InChIKey is CVKLSGQTXGYCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O/c1-21(15-6-2-3-7-15)17-9-5-4-8-16(17)20-18(22)13-19-12-14-10-11-14/h4-5,8-9,14-15,19H,2-3,6-7,10-13H2,1H3,(H,20,22).
What are the key properties of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide?
N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide has a molecular weight of 301.43 g/mol, XLogP of 3.00, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide is sourced from PubChem (CID 119899295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).