2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine

C13H27N3 — CID 83006832

IUPAC2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine
SMILESCC1CCCC(C)N1NCC1CCCNC1
InChIInChI=1S/C13H27N3/c1-11-5-3-6-12(2)16(11)15-10-13-7-4-8-14-9-13/h11-15H,3-10H2,1-2H3
InChIKeyKZURCTDBCQULGI-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.75
Rot. Bonds3

About 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine

2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine (PubChem CID 83006832) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine
PubChem CID83006832
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine
SMILESCC1CCCC(C)N1NCC1CCCNC1
InChIInChI=1S/C13H27N3/c1-11-5-3-6-12(2)16(11)15-10-13-7-4-8-14-9-13/h11-15H,3-10H2,1-2H3
InChIKeyKZURCTDBCQULGI-UHFFFAOYSA-N
XLogP1.75
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-3-ylmethyl)pyrrol-1-amine
CID 80555534
3-methyl-N-[[(3R)-piperidin-3-yl]methyl]cyclobutan-1-amine
CID 130522929
2-methyl-N-(piperidin-3-ylmethyl)cyclohexan-1-amine
CID 80553082
N-[[(3R)-piperidin-3-yl]methyl]ethanamine
CID 86317945
N-(piperidin-3-ylmethyl)cyclododecanamine
CID 83958102
2,6-dimethyl-N-(oxolan-3-ylmethyl)piperidin-1-amine
CID 83006909
N-(piperidin-3-ylmethyl)pyrrolidin-2-amine
CID 105440865
2-methoxy-N-(piperidin-3-ylmethyl)cyclopentan-1-amine
CID 62086661
1-(piperidin-3-ylmethyl)-3-propan-2-ylurea
CID 43208690
N-(2-cyclopropylethyl)-2,6-dimethylpiperidin-1-amine
CID 83013569
2-cyclobutyl-2-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 115209786
[2-(piperidin-3-ylmethylamino)cyclopentyl]methanol
CID 106359502

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine?
The IUPAC name of 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine (CID 83006832) is 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine.
What is the SMILES notation for 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine?
The canonical SMILES for 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine is CC1CCCC(C)N1NCC1CCCNC1.
What is the InChIKey of 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine?
The InChIKey is KZURCTDBCQULGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-11-5-3-6-12(2)16(11)15-10-13-7-4-8-14-9-13/h11-15H,3-10H2,1-2H3.
What are the key properties of 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine?
2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine has a molecular weight of 225.38 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine is sourced from PubChem (CID 83006832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).