2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide

C22H23N3O — CID 86941489

IUPAC2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide
SMILESCC(c1ccc2ccccc2c1)N(CC(=O)Nc1ccncc1)C1CC1
InChIInChI=1S/C22H23N3O/c1-16(18-7-6-17-4-2-3-5-19(17)14-18)25(21-8-9-21)15-22(26)24-20-10-12-23-13-11-20/h2-7,10-14,16,21H,8-9,15H2,1H3,(H,23,24,26)
InChIKeyIZFVMJIXPAZNOU-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.40
Rot. Bonds6

About 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide

2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide (PubChem CID 86941489) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide
PubChem CID86941489
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide
SMILESCC(c1ccc2ccccc2c1)N(CC(=O)Nc1ccncc1)C1CC1
InChIInChI=1S/C22H23N3O/c1-16(18-7-6-17-4-2-3-5-19(17)14-18)25(21-8-9-21)15-22(26)24-20-10-12-23-13-11-20/h2-7,10-14,16,21H,8-9,15H2,1H3,(H,23,24,26)
InChIKeyIZFVMJIXPAZNOU-UHFFFAOYSA-N
XLogP4.40
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-(propylcarbamoyl)acetamide
CID 60588161
N-(2-cyanophenyl)-3-[cyclopropyl(1-naphthalen-2-ylethyl)amino]propanamide
CID 56525819
3-[[cyclopropyl-[(1S)-1-naphthalen-2-ylethyl]amino]methyl]benzamide
CID 95043843
2-naphthalen-2-yl-N-pyridin-4-ylacetamide
CID 25336159
N-(4-butan-2-ylphenyl)-2-[cyclopropyl(propan-2-yl)amino]acetamide
CID 112818363
2-[acetyl(cyclopropyl)amino]-N-(4-propan-2-ylphenyl)acetamide
CID 113158405
N-cyclopropyl-2-methyl-3-(methylamino)-N-(1-naphthalen-2-ylethyl)propanamide;hydrochloride
CID 119749339
2-(N-methylsulfonyl-4-propan-2-ylanilino)-N-naphthalen-2-ylacetamide
CID 30168762
2-naphthalen-2-yloxy-N-pyridin-4-ylacetamide
CID 823638
2-(dimethylamino)-N-naphthalen-2-ylacetamide
CID 54844205
N-(3-chlorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
CID 46602371
2-[[(1S)-1-(4-chlorophenyl)ethyl]-cyclopropylamino]-N-(2-nitrophenyl)acetamide
CID 51965724

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide?
The IUPAC name of 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide (CID 86941489) is 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide?
The canonical SMILES for 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide is CC(c1ccc2ccccc2c1)N(CC(=O)Nc1ccncc1)C1CC1.
What is the InChIKey of 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide?
The InChIKey is IZFVMJIXPAZNOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-16(18-7-6-17-4-2-3-5-19(17)14-18)25(21-8-9-21)15-22(26)24-20-10-12-23-13-11-20/h2-7,10-14,16,21H,8-9,15H2,1H3,(H,23,24,26).
What are the key properties of 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide?
2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide has a molecular weight of 345.45 g/mol, XLogP of 4.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(1-naphthalen-2-ylethyl)amino]-N-pyridin-4-ylacetamide is sourced from PubChem (CID 86941489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).