N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide

C16H30N2O2 — CID 65152218

IUPACN-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide
SMILESNCCCN(C(=O)CCC1CCCO1)C1CCCCC1
InChIInChI=1S/C16H30N2O2/c17-11-5-12-18(14-6-2-1-3-7-14)16(19)10-9-15-8-4-13-20-15/h14-15H,1-13,17H2
InChIKeyIPRRRQVGWJKIHD-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.46
Rot. Bonds7

About N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide

N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide (PubChem CID 65152218) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide
PubChem CID65152218
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide
SMILESNCCCN(C(=O)CCC1CCCO1)C1CCCCC1
InChIInChI=1S/C16H30N2O2/c17-11-5-12-18(14-6-2-1-3-7-14)16(19)10-9-15-8-4-13-20-15/h14-15H,1-13,17H2
InChIKeyIPRRRQVGWJKIHD-UHFFFAOYSA-N
XLogP2.46
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-cyclobutyl-3-(oxolan-2-yl)propanamide
CID 102874215
N-(2-aminoethyl)-N-cyclopropyl-3-(oxan-2-yl)propanamide
CID 63952702
N-(3-aminopropyl)-N-cyclobutyl-2-(oxan-2-yl)acetamide
CID 102873969
N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 65152557
3-amino-N-(3-aminopropyl)-N-cyclohexylpropanamide
CID 134484716
N'-cyclohexyl-N'-[2-(oxolan-2-yl)ethyl]propane-1,3-diamine
CID 65158410
N-(3-aminopropyl)-N-cycloheptylbutanamide
CID 43136885
N-(3-aminopropyl)-N-cyclohexyloxolane-2-carboxamide
CID 43136866
2-[cyclopropyl-[3-[(2S)-oxolan-2-yl]propanoyl]amino]acetic acid
CID 93332934
N-(3-aminopropyl)-N-cycloheptyl-4-methylpentanamide
CID 43319420
N-(3-aminopropyl)-N-cycloheptylheptanamide
CID 114751887
N-butyl-N-methyl-3-(oxolan-2-yl)propanamide
CID 86929613

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide (CID 65152218) is N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide is NCCCN(C(=O)CCC1CCCO1)C1CCCCC1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide?
The InChIKey is IPRRRQVGWJKIHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c17-11-5-12-18(14-6-2-1-3-7-14)16(19)10-9-15-8-4-13-20-15/h14-15H,1-13,17H2.
What are the key properties of N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide?
N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide has a molecular weight of 282.43 g/mol, XLogP of 2.46, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide is sourced from PubChem (CID 65152218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).