N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide

C18H24N2O — CID 106357235

IUPACN-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide
SMILESCC(C)(C)C(CCN)NC(=O)c1cccc2ccccc12
InChIInChI=1S/C18H24N2O/c1-18(2,3)16(11-12-19)20-17(21)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,16H,11-12,19H2,1-3H3,(H,20,21)
InChIKeyDPOKVDSQORXMHY-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.33
Rot. Bonds4

About N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide

N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide (PubChem CID 106357235) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide
PubChem CID106357235
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide
SMILESCC(C)(C)C(CCN)NC(=O)c1cccc2ccccc12
InChIInChI=1S/C18H24N2O/c1-18(2,3)16(11-12-19)20-17(21)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,16H,11-12,19H2,1-3H3,(H,20,21)
InChIKeyDPOKVDSQORXMHY-UHFFFAOYSA-N
XLogP3.33
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-4,4-dimethylpentan-3-yl)-2-hydroxy-3-methylbenzamide
CID 106357259
N-(1-amino-4,4-dimethylpentan-3-yl)-1-benzofuran-3-carboxamide
CID 106357075
tert-butyl (2S)-6-amino-2-(naphthalene-1-carbonylamino)hexanoate
CID 102277216
N-(1-amino-4,4-dimethylpentan-3-yl)-2,6-dimethylbenzamide
CID 106357063
N-(1-aminopentan-2-yl)naphthalene-1-carboxamide
CID 65191426
4-amino-2-methyl-1-naphthalen-1-ylbutan-1-one
CID 116595056
N-(1-naphthalen-1-ylethyl)naphthalene-1-carboxamide
CID 593320
N-(1-amino-2-methylpropan-2-yl)naphthalene-1-carboxamide;hydrochloride
CID 119522938
N-(1-amino-4,4-dimethylpentan-3-yl)-4-methylbenzamide
CID 114178197
N-(1-amino-4,4-dimethylpentan-3-yl)-5-fluoro-2-hydroxybenzamide
CID 106356974
(2S)-2-(naphthalene-1-carbonylamino)propanoic acid
CID 11637328
N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide
CID 10424319

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide?
The IUPAC name of N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide (CID 106357235) is N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide?
The canonical SMILES for N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide is CC(C)(C)C(CCN)NC(=O)c1cccc2ccccc12.
What is the InChIKey of N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide?
The InChIKey is DPOKVDSQORXMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-18(2,3)16(11-12-19)20-17(21)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,16H,11-12,19H2,1-3H3,(H,20,21).
What are the key properties of N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide?
N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 3.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4,4-dimethylpentan-3-yl)naphthalene-1-carboxamide is sourced from PubChem (CID 106357235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).