N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide

C18H24N2O — CID 62050441

IUPACN-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide
SMILESCC(NCc1cccc2ccccc12)C(=O)NC(C)(C)C
InChIInChI=1S/C18H24N2O/c1-13(17(21)20-18(2,3)4)19-12-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,13,19H,12H2,1-4H3,(H,20,21)
InChIKeyIFRLPILFYXINGL-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.23
Rot. Bonds4

About N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide

N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide (PubChem CID 62050441) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide
PubChem CID62050441
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide
SMILESCC(NCc1cccc2ccccc12)C(=O)NC(C)(C)C
InChIInChI=1S/C18H24N2O/c1-13(17(21)20-18(2,3)4)19-12-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,13,19H,12H2,1-4H3,(H,20,21)
InChIKeyIFRLPILFYXINGL-UHFFFAOYSA-N
XLogP3.23
TPSA41.13 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 ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[[[1-(tert-butylamino)-1-oxopropan-2-yl]amino]methyl]benzoate
CID 115905036
tert-butyl N-[2-(naphthalen-1-ylmethylamino)propyl]carbamate
CID 103389782
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CID 43087569
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CID 47185263
N,4-dimethyl-2-(naphthalen-1-ylmethylamino)pentanamide
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2-[(4-bromothiophen-3-yl)methylamino]-N-tert-butylpropanamide
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N-tert-butyl-2-[[3-(methoxymethyl)phenyl]methylamino]propanamide
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(2S)-3-naphthalen-1-yl-2-(naphthalen-1-ylmethylamino)propanoic acid
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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide?
The IUPAC name of N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide (CID 62050441) is N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide.
What is the SMILES notation for N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide?
The canonical SMILES for N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide is CC(NCc1cccc2ccccc12)C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide?
The InChIKey is IFRLPILFYXINGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13(17(21)20-18(2,3)4)19-12-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,13,19H,12H2,1-4H3,(H,20,21).
What are the key properties of N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide?
N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide has a molecular weight of 284.40 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide is sourced from PubChem (CID 62050441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).