N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine

C15H31N3 — CID 107069105

IUPACN,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine
SMILESCC1CCCNC1CN1CCC(CN(C)C)CC1
InChIInChI=1S/C15H31N3/c1-13-5-4-8-16-15(13)12-18-9-6-14(7-10-18)11-17(2)3/h13-16H,4-12H2,1-3H3
InChIKeyCFFPKFKJKWUPLC-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.65
Rot. Bonds4

About N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine

N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine (PubChem CID 107069105) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine
PubChem CID107069105
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine
SMILESCC1CCCNC1CN1CCC(CN(C)C)CC1
InChIInChI=1S/C15H31N3/c1-13-5-4-8-16-15(13)12-18-9-6-14(7-10-18)11-17(2)3/h13-16H,4-12H2,1-3H3
InChIKeyCFFPKFKJKWUPLC-UHFFFAOYSA-N
XLogP1.65
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methyl-4-(piperidin-4-yl)piperazine
CID 795707
1-(2-Piperidinylmethyl)piperidine
CID 254290
N-(cyclohexylmethyl)-1-ethylpiperidin-4-amine
CID 2846481
1-(4-Methyl-cyclohexyl)-piperazinehydrochloride
CID 16188159
1-(1-Methyl-4-piperidinyl)piperazine
CID 566324
4,4'-Bipiperidine
CID 736050
1-(Cyclohexylmethyl)piperazine
CID 2735885
3-Methyl-1,4'-bipiperidine
CID 2760044
(2S,3S)-2-((R)-4-(3-cyclohexylpropyl)-3-isopropylpiperazin-1-yl)-N,3-dimethylpentan-1-amine
CID 45482257
Quinuclidine, 2-((2-diethylaminoethyl)aminomethyl)-
CID 3053134
4-Methyl-1,4'-bipiperidine
CID 795715
1-Methyl-4-(piperidin-3-ylmethyl)piperazine
CID 20668416

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine (CID 107069105) is N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine is CC1CCCNC1CN1CCC(CN(C)C)CC1.
What is the InChIKey of N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine?
The InChIKey is CFFPKFKJKWUPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-13-5-4-8-16-15(13)12-18-9-6-14(7-10-18)11-17(2)3/h13-16H,4-12H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine?
N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine has a molecular weight of 253.43 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[1-[(3-methylpiperidin-2-yl)methyl]piperidin-4-yl]methanamine is sourced from PubChem (CID 107069105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).