N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine

C16H33N3 — CID 55160102

IUPACN,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine
SMILESCCCNC1CCCCC1CN1CCC(N(C)C)C1
InChIInChI=1S/C16H33N3/c1-4-10-17-16-8-6-5-7-14(16)12-19-11-9-15(13-19)18(2)3/h14-17H,4-13H2,1-3H3
InChIKeyIHFOZERXIMXAPU-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.18
Rot. Bonds6

About N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine

N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine (PubChem CID 55160102) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine
PubChem CID55160102
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC NameN,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine
SMILESCCCNC1CCCCC1CN1CCC(N(C)C)C1
InChIInChI=1S/C16H33N3/c1-4-10-17-16-8-6-5-7-14(16)12-19-11-9-15(13-19)18(2)3/h14-17H,4-13H2,1-3H3
InChIKeyIHFOZERXIMXAPU-UHFFFAOYSA-N
XLogP2.18
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-1-[[2-(propylamino)cyclopentyl]methyl]pyrrolidin-3-amine
CID 63169213
N,N-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidin-4-amine
CID 79569939
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-N-propylcyclohexan-1-amine
CID 79945526
2-[(4-cyclopropylpiperazin-1-yl)methyl]-N-propylcyclohexan-1-amine
CID 62614441
2-[(2-methyl-1,4-oxazepan-4-yl)methyl]-N-propylcycloheptan-1-amine
CID 62973181
2-[1-[[2-(propylamino)cyclohexyl]methyl]piperidin-3-yl]ethanol
CID 107228969
N-propyl-2-[(4-propylpiperazin-1-yl)methyl]cyclopentan-1-amine
CID 55094030
2-[(4-propan-2-ylpiperazin-1-yl)methyl]-N-propylcyclohexan-1-amine
CID 62616357
2-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-N-propylcyclohexan-1-amine
CID 62616535
2-[(2-methylmorpholin-4-yl)methyl]-N-propylcyclopentan-1-amine
CID 55093836
2-[[4-(methoxymethyl)piperidin-1-yl]methyl]-N-propylcycloheptan-1-amine
CID 63973579
N,N-dimethyl-1-[[4-(propylamino)oxan-3-yl]methyl]piperidin-4-amine
CID 103058865

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine?
The IUPAC name of N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine (CID 55160102) is N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine is CCCNC1CCCCC1CN1CCC(N(C)C)C1.
What is the InChIKey of N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine?
The InChIKey is IHFOZERXIMXAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-4-10-17-16-8-6-5-7-14(16)12-19-11-9-15(13-19)18(2)3/h14-17H,4-13H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine?
N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine has a molecular weight of 267.46 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[2-(propylamino)cyclohexyl]methyl]pyrrolidin-3-amine is sourced from PubChem (CID 55160102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).