1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine

C12H22N4 — CID 79069821

IUPAC1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine
SMILESCN(C)C1(C(N)c2nccn2C)CCCC1
InChIInChI=1S/C12H22N4/c1-15(2)12(6-4-5-7-12)10(13)11-14-8-9-16(11)3/h8-10H,4-7,13H2,1-3H3
InChIKeyWRICNNSQALVYAM-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.29
Rot. Bonds3

About 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine

1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine (PubChem CID 79069821) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine
PubChem CID79069821
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine
SMILESCN(C)C1(C(N)c2nccn2C)CCCC1
InChIInChI=1S/C12H22N4/c1-15(2)12(6-4-5-7-12)10(13)11-14-8-9-16(11)3/h8-10H,4-7,13H2,1-3H3
InChIKeyWRICNNSQALVYAM-UHFFFAOYSA-N
XLogP1.29
TPSA47.08 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 ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[amino-(1-propylimidazol-2-yl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79069803
1-[1-amino-3-(1-methylimidazol-2-yl)propyl]-N,N-dimethylcyclohexan-1-amine
CID 114530454
(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine
CID 63975391
N,N-diethyl-1-[ethylamino-(1-methylimidazol-2-yl)methyl]cyclopentan-1-amine
CID 79070501
[1-(3,4-dichlorophenyl)cyclobutyl]-(1-methylimidazol-2-yl)methanamine
CID 13300451
(1R)-1-(1-methylimidazol-2-yl)ethanamine
CID 42220137
1-[hydroxy-(1-methylimidazol-2-yl)methyl]cyclopentan-1-ol
CID 103448415
1-[amino-(3-methyltriazol-4-yl)methyl]-N,N-dimethylcycloheptan-1-amine
CID 114688421
(1S)-1-(1-methylimidazol-2-yl)ethanamine;dihydrochloride
CID 162341662
1-[1-(dimethylamino)cyclohexyl]-3-(1-methylimidazol-2-yl)propan-1-ol
CID 114529797
N,N-dimethyl-1-[methylamino-(1-propylimidazol-2-yl)methyl]cycloheptan-1-amine
CID 79064561
(1-methylimidazol-2-yl)-(1-pyrrolidin-1-ylcyclopentyl)methanol
CID 79057165

Frequently Asked Questions

What is the IUPAC name of 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine?
The IUPAC name of 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine (CID 79069821) is 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine is CN(C)C1(C(N)c2nccn2C)CCCC1.
What is the InChIKey of 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine?
The InChIKey is WRICNNSQALVYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-15(2)12(6-4-5-7-12)10(13)11-14-8-9-16(11)3/h8-10H,4-7,13H2,1-3H3.
What are the key properties of 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine?
1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine has a molecular weight of 222.34 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[amino-(1-methylimidazol-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79069821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).