N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine

C15H29NO — CID 115707843

IUPACN-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine
SMILESCC(CC1CC1)NCCCOC1CCCCC1
InChIInChI=1S/C15H29NO/c1-13(12-14-8-9-14)16-10-5-11-17-15-6-3-2-4-7-15/h13-16H,2-12H2,1H3
InChIKeyRFYWDYHACXQUCZ-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.50
Rot. Bonds8

About N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine

N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine (PubChem CID 115707843) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine.

Molecular Properties

Compound NameN-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine
PubChem CID115707843
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine
SMILESCC(CC1CC1)NCCCOC1CCCCC1
InChIInChI=1S/C15H29NO/c1-13(12-14-8-9-14)16-10-5-11-17-15-6-3-2-4-7-15/h13-16H,2-12H2,1H3
InChIKeyRFYWDYHACXQUCZ-UHFFFAOYSA-N
XLogP3.50
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-(3-cyclohexyloxypropyl)-1-methylsulfanylpropan-2-amine
CID 125443596
N-(3-cyclohexyloxypropyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79540247
1-cyclopropyl-N-[3-(oxolan-3-yloxy)propyl]propan-2-amine
CID 115727743
3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine
CID 43362870
N-(3-cyclohexyloxypropyl)-3-methylpentan-2-amine
CID 43104261
N-(1-cyclopropylpropan-2-yl)-4-methylpentan-1-amine
CID 81300289
1-cyclopropyl-N-(3-cyclopropylpropyl)propan-2-amine
CID 115890825
(2R)-N-(3-cyclopentyloxypropyl)-1-morpholin-4-ylpropan-2-amine
CID 125435142
1-cyclopentyl-N-(2-propan-2-yloxyethyl)propan-2-amine
CID 104584684
N-(1-cyclohexylpropan-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 165494361
3-cyclohexyloxy-N-(1-phenylethyl)propan-1-amine
CID 43079659
N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine
CID 91064038

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine?
The IUPAC name of N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine (CID 115707843) is N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine.
What is the SMILES notation for N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine?
The canonical SMILES for N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine is CC(CC1CC1)NCCCOC1CCCCC1.
What is the InChIKey of N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine?
The InChIKey is RFYWDYHACXQUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-13(12-14-8-9-14)16-10-5-11-17-15-6-3-2-4-7-15/h13-16H,2-12H2,1H3.
What are the key properties of N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine?
N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine has a molecular weight of 239.40 g/mol, XLogP of 3.50, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine is sourced from PubChem (CID 115707843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).