N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide

C18H26N2O — CID 79377266

IUPACN-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide
SMILESCC1(C)CCC(NCCC(=O)NC2CC2)c2ccccc21
InChIInChI=1S/C18H26N2O/c1-18(2)11-9-16(14-5-3-4-6-15(14)18)19-12-10-17(21)20-13-7-8-13/h3-6,13,16,19H,7-12H2,1-2H3,(H,20,21)
InChIKeyPWHYXXJQBMOJSR-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.06
Rot. Bonds5

About N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide

N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide (PubChem CID 79377266) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide
PubChem CID79377266
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide
SMILESCC1(C)CCC(NCCC(=O)NC2CC2)c2ccccc21
InChIInChI=1S/C18H26N2O/c1-18(2)11-9-16(14-5-3-4-6-15(14)18)19-12-10-17(21)20-13-7-8-13/h3-6,13,16,19H,7-12H2,1-2H3,(H,20,21)
InChIKeyPWHYXXJQBMOJSR-UHFFFAOYSA-N
XLogP3.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-3-(2,3-dihydro-1H-inden-1-ylamino)propanamide
CID 62626829
7-amino-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)heptanamide;hydrochloride
CID 119758371
N-cyclopropyl-3-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylamino)propanamide
CID 79386308
2-(cyclopropylmethylamino)-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide;hydrochloride
CID 119758390
N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)-N',N'-dimethylpropane-1,3-diamine
CID 43147385
4,4-dimethyl-N-pent-3-ynyl-2,3-dihydro-1H-naphthalen-1-amine
CID 116642933
N-(2,2-difluoroethyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 113303571
1-cyclopropyl-2-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]ethanol
CID 63294204
N,4,4-trimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 43147302
3-[2-[[(1S)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]amino]ethyl]imidazolidine-2,4-dione
CID 124726189
(2R)-2-acetamido-N-[(1S)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl]pentanediamide
CID 95156854
4,4-dimethyl-N-[2-(oxolan-3-yl)ethyl]-2,3-dihydro-1H-naphthalen-1-amine
CID 102672100

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide (CID 79377266) is N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide is CC1(C)CCC(NCCC(=O)NC2CC2)c2ccccc21.
What is the InChIKey of N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide?
The InChIKey is PWHYXXJQBMOJSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-18(2)11-9-16(14-5-3-4-6-15(14)18)19-12-10-17(21)20-13-7-8-13/h3-6,13,16,19H,7-12H2,1-2H3,(H,20,21).
What are the key properties of N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide?
N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide has a molecular weight of 286.42 g/mol, XLogP of 3.06, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propanamide is sourced from PubChem (CID 79377266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).