3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine

C12H21N3 — CID 114532157

IUPAC3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
SMILESCn1ccnc1CCC1(C)CCC(N)C1
InChIInChI=1S/C12H21N3/c1-12(5-3-10(13)9-12)6-4-11-14-7-8-15(11)2/h7-8,10H,3-6,9,13H2,1-2H3
InChIKeyUZUIAPVKCRCULG-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.87
Rot. Bonds3

About 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine

3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine (PubChem CID 114532157) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
PubChem CID114532157
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
SMILESCn1ccnc1CCC1(C)CCC(N)C1
InChIInChI=1S/C12H21N3/c1-12(5-3-10(13)9-12)6-4-11-14-7-8-15(11)2/h7-8,10H,3-6,9,13H2,1-2H3
InChIKeyUZUIAPVKCRCULG-UHFFFAOYSA-N
XLogP1.87
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-[2-(1-methylimidazol-2-yl)ethyl]cyclohexan-1-ol
CID 114529231
3-amino-1-[(1-methylimidazol-2-yl)methyl]cyclopentan-1-ol
CID 80562581
3-amino-1-(1-methylimidazol-2-yl)cyclopentan-1-ol
CID 80562885
3-methyl-3-(1-methylimidazol-2-yl)cyclopentan-1-amine
CID 116538901
2-[2-[1-(bromomethyl)cyclopentyl]ethyl]-1-methylimidazole
CID 114532734
1-[2-(1-methylimidazol-2-yl)ethyl]-4-propylcycloheptan-1-amine
CID 114529396
3,3-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-ol
CID 114529236
4-ethyl-1-[2-(1-methylimidazol-2-yl)ethyl]cyclohexane-1-carboxylic acid
CID 114532598
1-(4-aminocyclohexyl)-3-(1-methylimidazol-2-yl)propan-1-one
CID 114533209
trans-(1R,3S)-3-amino-1-(1-methylimidazol-2-yl)cyclohexan-1-ol
CID 154850428
1-(1-methylcyclopropyl)-3-(1-methylimidazol-2-yl)propan-1-one
CID 114529606
2-[2-[1-(1-chloroethyl)cyclopropyl]ethyl]-1-methylimidazole
CID 106798396

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine (CID 114532157) is 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine is Cn1ccnc1CCC1(C)CCC(N)C1.
What is the InChIKey of 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
The InChIKey is UZUIAPVKCRCULG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-12(5-3-10(13)9-12)6-4-11-14-7-8-15(11)2/h7-8,10H,3-6,9,13H2,1-2H3.
What are the key properties of 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine?
3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 114532157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).