N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine

C17H35N3 — CID 63169213

IUPACN,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine
SMILESCCCNC1CCCC1CN1CCC(N(CC)CC)C1
InChIInChI=1S/C17H35N3/c1-4-11-18-17-9-7-8-15(17)13-19-12-10-16(14-19)20(5-2)6-3/h15-18H,4-14H2,1-3H3
InChIKeyGXAWWAJQUGWEQU-UHFFFAOYSA-N
MW281.49 g/mol
LogP2.57
Rot. Bonds8

About N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine

N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine (PubChem CID 63169213) has the molecular formula C17H35N3 and a molecular weight of 281.49 g/mol. Its IUPAC name is N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine
PubChem CID63169213
Molecular FormulaC17H35N3
Molecular Weight281.49 g/mol
Exact Mass281.28
IUPAC NameN,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine
SMILESCCCNC1CCCC1CN1CCC(N(CC)CC)C1
InChIInChI=1S/C17H35N3/c1-4-11-18-17-9-7-8-15(17)13-19-12-10-16(14-19)20(5-2)6-3/h15-18H,4-14H2,1-3H3
InChIKeyGXAWWAJQUGWEQU-UHFFFAOYSA-N
XLogP2.57
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.49
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine
CID 55160102
N-ethyl-N-[[2-(propylamino)cyclopentyl]methyl]cyclohexanamine
CID 62615159
N-propyl-2-[(4-propylpiperazin-1-yl)methyl]cyclopentan-1-amine
CID 55094030
2-[(2-methylmorpholin-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 55093836
2-[(2-methyl-1,4-oxazepan-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 62973885
2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol
CID 107228969
2-[(4-propan-2-ylpiperazin-1-yl)methyl]-N-propylcyclopentan-1-amine
CID 62616468
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-N-propylcyclohexan-1-amine
CID 79945526
N,N-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidin-4-amine
CID 79569939
2-[(4-cyclopropylpiperazin-1-yl)methyl]-N-propylcyclohexan-1-amine
CID 62614441
N,1-dimethyl-N-[[2-(propylamino)cyclopentyl]methyl]piperidin-3-amine
CID 55094812
2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-ylmethyl)-N-propylcyclopentan-1-amine
CID 64578664

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
The IUPAC name of N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine (CID 63169213) is N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
The canonical SMILES for N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine is CCCNC1CCCC1CN1CCC(N(CC)CC)C1.
What is the InChIKey of N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
The InChIKey is GXAWWAJQUGWEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3/c1-4-11-18-17-9-7-8-15(17)13-19-12-10-16(14-19)20(5-2)6-3/h15-18H,4-14H2,1-3H3.
What are the key properties of N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine has a molecular weight of 281.49 g/mol, XLogP of 2.57, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine is sourced from PubChem (CID 63169213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).