N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide

C17H34N2O — CID 79667842

IUPACN-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide
SMILESCCCN(CC(C)(C)CN)C(=O)CCC1CCCCC1
InChIInChI=1S/C17H34N2O/c1-4-12-19(14-17(2,3)13-18)16(20)11-10-15-8-6-5-7-9-15/h15H,4-14,18H2,1-3H3
InChIKeyADFHWVUFSBDNRS-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.57
Rot. Bonds8

About N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide

N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide (PubChem CID 79667842) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide
PubChem CID79667842
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide
SMILESCCCN(CC(C)(C)CN)C(=O)CCC1CCCCC1
InChIInChI=1S/C17H34N2O/c1-4-12-19(14-17(2,3)13-18)16(20)11-10-15-8-6-5-7-9-15/h15H,4-14,18H2,1-3H3
InChIKeyADFHWVUFSBDNRS-UHFFFAOYSA-N
XLogP3.57
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-propylcyclohexanecarboxamide
CID 79668335
N-(cyanomethyl)-3-cyclohexyl-N-propylpropanamide
CID 61224500
3-amino-N-(cyclohexylmethyl)-N-propylpropanamide
CID 119302227
3-cyclopentyl-N,N-dipentylpropanamide
CID 4248024
3-cyclopentyl-N,N-diheptylpropanamide
CID 532988
3-cyclohexyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 103857392
3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide
CID 78858621
N-(3-amino-2,2-dimethylpropyl)-N-propylthiolane-3-carboxamide
CID 79668421
N-ethyl-3-piperidin-4-yl-N-propylpropanamide
CID 62210157
3-cyclopentyl-N-ethyl-N-prop-2-ynylpropanamide
CID 78970322
N-(3-amino-2,2-dimethylpropyl)-5-methyl-N-propyloxolane-3-carboxamide
CID 114826446
N'-cyclobutyl-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 79668549

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide (CID 79667842) is N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide is CCCN(CC(C)(C)CN)C(=O)CCC1CCCCC1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide?
The InChIKey is ADFHWVUFSBDNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-12-19(14-17(2,3)13-18)16(20)11-10-15-8-6-5-7-9-15/h15H,4-14,18H2,1-3H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide?
N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide has a molecular weight of 282.47 g/mol, XLogP of 3.57, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-3-cyclohexyl-N-propylpropanamide is sourced from PubChem (CID 79667842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).