2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine

C12H22N4 — CID 83007117

IUPAC2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine
SMILESCC1CCCC(C)N1NCc1cncn1C
InChIInChI=1S/C12H22N4/c1-10-5-4-6-11(2)16(10)14-8-12-7-13-9-15(12)3/h7,9-11,14H,4-6,8H2,1-3H3
InChIKeyIMFAUYXDNFNTEB-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.69
Rot. Bonds3

About 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine

2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine (PubChem CID 83007117) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine
PubChem CID83007117
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine
SMILESCC1CCCC(C)N1NCc1cncn1C
InChIInChI=1S/C12H22N4/c1-10-5-4-6-11(2)16(10)14-8-12-7-13-9-15(12)3/h7,9-11,14H,4-6,8H2,1-3H3
InChIKeyIMFAUYXDNFNTEB-UHFFFAOYSA-N
XLogP1.69
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5H,6H,7H,8H-imidazo(1,2-a)pyridin-2-ylmethanamine
CID 47003215
Imidazole, 1-methyl-5-(4-methylpiperidinoiminomethyl)-2-nitro-
CID 3052892
N-[(1-isobutyl-1H-imidazol-5-yl)methyl]-3-piperidinamine dihydrochloride
CID 56701558
N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine
CID 135898799
5-(Hydrazinylmethyl)-1-methyl-1H-imidazole hydrochloride (1:1)
CID 46942149
1-(5H,6H,7H,8H-imidazo(1,2-a)pyridin-3-yl)methanamine
CID 50989750
4-(5-methyl-1H-imidazol-1-yl)piperidine dihydrochloride
CID 75481329
1-[(1-methyl-1H-imidazol-5-yl)methyl]-4-(1-methylpiperidin-4-yl)piperazine
CID 77081273
2-(1-methyl-1H-imidazol-5-yl)piperidine
CID 82596980
2-(1-ethyl-1H-imidazol-5-yl)piperidine
CID 86812056
1-[(1-cyclohexyl-1H-imidazol-5-yl)methyl]piperazine
CID 91839083
1-(3,5-dimethylpiperidin-1-yl)-N-[(3-methylimidazol-4-yl)methyl]propan-2-amine
CID 119110237

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine?
The IUPAC name of 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine (CID 83007117) is 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine.
What is the SMILES notation for 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine?
The canonical SMILES for 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine is CC1CCCC(C)N1NCc1cncn1C.
What is the InChIKey of 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine?
The InChIKey is IMFAUYXDNFNTEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-10-5-4-6-11(2)16(10)14-8-12-7-13-9-15(12)3/h7,9-11,14H,4-6,8H2,1-3H3.
What are the key properties of 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine?
2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine has a molecular weight of 222.34 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine is sourced from PubChem (CID 83007117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).