N,N-dicyclohexylpyrrolidin-3-amine

C16H30N2 — CID 78989096

IUPACN,N-dicyclohexylpyrrolidin-3-amine
SMILESC1CCC(N(C2CCCCC2)C2CCNC2)CC1
InChIInChI=1S/C16H30N2/c1-3-7-14(8-4-1)18(16-11-12-17-13-16)15-9-5-2-6-10-15/h14-17H,1-13H2
InChIKeyYLAZQLROZXXUKH-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.32
Rot. Bonds3

About N,N-dicyclohexylpyrrolidin-3-amine

N,N-dicyclohexylpyrrolidin-3-amine (PubChem CID 78989096) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is N,N-dicyclohexylpyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-dicyclohexylpyrrolidin-3-amine
PubChem CID78989096
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC NameN,N-dicyclohexylpyrrolidin-3-amine
SMILESC1CCC(N(C2CCCCC2)C2CCNC2)CC1
InChIInChI=1S/C16H30N2/c1-3-7-14(8-4-1)18(16-11-12-17-13-16)15-9-5-2-6-10-15/h14-17H,1-13H2
InChIKeyYLAZQLROZXXUKH-UHFFFAOYSA-N
XLogP3.32
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azetidin-3-yl)-N-cyclopropylpyrrolidin-3-amine
CID 131209086
N,N-dicyclohexylcyclohexanamine
CID 175770337
N-cyclohexyl-N-ethylpyrrolidin-3-amine;hydrochloride
CID 156593457
N-cyclohexyl-N-ethylpyrrolidin-3-amine;dihydrochloride
CID 56831616
1-N,6-N-dicyclohexyl-1-N,6-N-di(piperidin-3-yl)-1,2,3,3a,4,5,5a,6,7,8,8a,9,10,10a,10b,10c-hexadecahydropyrene-1,6-diamine
CID 140550517
N-[cyclohexyl(methyl)sulfamoyl]-N-methylpyrrolidin-3-amine;hydrochloride
CID 119978613
(4aR,9aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-cyclohepta[c]pyridine
CID 92720083
(4aS,10aR)-1,2,3,4,4a,5,6,7,8,9,10,10a-dodecahydrocycloocta[c]pyridine
CID 164752917
N-cyclohexyl-N-methylpiperidin-3-amine;dihydrochloride
CID 56831585
(3S)-N,N-dimethylazepan-3-amine;dihydrochloride
CID 170898378
N-cyclohexyl-N-ethyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119923071
(3R)-N-cyclopropyl-N-methylpyrrolidin-3-amine
CID 66569483

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexylpyrrolidin-3-amine?
The IUPAC name of N,N-dicyclohexylpyrrolidin-3-amine (CID 78989096) is N,N-dicyclohexylpyrrolidin-3-amine.
What is the SMILES notation for N,N-dicyclohexylpyrrolidin-3-amine?
The canonical SMILES for N,N-dicyclohexylpyrrolidin-3-amine is C1CCC(N(C2CCCCC2)C2CCNC2)CC1.
What is the InChIKey of N,N-dicyclohexylpyrrolidin-3-amine?
The InChIKey is YLAZQLROZXXUKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-3-7-14(8-4-1)18(16-11-12-17-13-16)15-9-5-2-6-10-15/h14-17H,1-13H2.
What are the key properties of N,N-dicyclohexylpyrrolidin-3-amine?
N,N-dicyclohexylpyrrolidin-3-amine has a molecular weight of 250.43 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexylpyrrolidin-3-amine is sourced from PubChem (CID 78989096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).