N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine

C10H17N3 — CID 62741574

IUPACN-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine
SMILESCc1ncc(CNC2CCCC2)[nH]1
InChIInChI=1S/C10H17N3/c1-8-11-6-10(13-8)7-12-9-4-2-3-5-9/h6,9,12H,2-5,7H2,1H3,(H,11,13)
InChIKeyQKUYNGDGUZXDFN-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.75
Rot. Bonds3

About N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine

N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine (PubChem CID 62741574) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine.

Molecular Properties

Compound NameN-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine
PubChem CID62741574
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine
SMILESCc1ncc(CNC2CCCC2)[nH]1
InChIInChI=1S/C10H17N3/c1-8-11-6-10(13-8)7-12-9-4-2-3-5-9/h6,9,12H,2-5,7H2,1H3,(H,11,13)
InChIKeyQKUYNGDGUZXDFN-UHFFFAOYSA-N
XLogP1.75
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine?
The IUPAC name of N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine (CID 62741574) is N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine.
What is the SMILES notation for N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine?
The canonical SMILES for N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine is Cc1ncc(CNC2CCCC2)[nH]1.
What is the InChIKey of N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine?
The InChIKey is QKUYNGDGUZXDFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8-11-6-10(13-8)7-12-9-4-2-3-5-9/h6,9,12H,2-5,7H2,1H3,(H,11,13).
What are the key properties of N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine?
N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine has a molecular weight of 179.27 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-1H-imidazol-5-yl)methyl]cyclopentanamine is sourced from PubChem (CID 62741574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).