N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine

C13H17N3O — CID 63204637

IUPACN-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine
SMILESc1cn(C2CCCC2NCc2ccoc2)cn1
InChIInChI=1S/C13H17N3O/c1-2-12(15-8-11-4-7-17-9-11)13(3-1)16-6-5-14-10-16/h4-7,9-10,12-13,15H,1-3,8H2
InChIKeyGULGLHSMFGZNGL-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.36
Rot. Bonds4

About N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine

N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine (PubChem CID 63204637) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine
PubChem CID63204637
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC NameN-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine
SMILESc1cn(C2CCCC2NCc2ccoc2)cn1
InChIInChI=1S/C13H17N3O/c1-2-12(15-8-11-4-7-17-9-11)13(3-1)16-6-5-14-10-16/h4-7,9-10,12-13,15H,1-3,8H2
InChIKeyGULGLHSMFGZNGL-UHFFFAOYSA-N
XLogP2.36
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-imidazol-1-yl-N-[(1-methylpyrrol-3-yl)methyl]cyclopentan-1-amine
CID 66398331
2-imidazol-1-yl-N-[(4-methoxyphenyl)methyl]cyclopentan-1-amine
CID 43734301
2-imidazol-1-yl-N-[(3,4,5-trifluorophenyl)methyl]cyclopentan-1-amine
CID 63051722
N-[(5-ethylthiophen-2-yl)methyl]-2-imidazol-1-ylcyclopentan-1-amine
CID 55062118
N-[(5-ethylfuran-2-yl)methyl]-2-imidazol-1-ylcyclopentan-1-amine
CID 62345276
2-imidazol-1-yl-N-[(3-methoxyphenyl)methyl]cyclopentan-1-amine
CID 43734304
2-imidazol-1-yl-N-(2-methylpropyl)cyclopentan-1-amine
CID 43734339
N-[(2-bromophenyl)methyl]-2-imidazol-1-ylcyclopentan-1-amine
CID 43734382
2-imidazol-1-yl-N-[(2-methylphenyl)methyl]cyclopentan-1-amine
CID 43734309
N-butyl-2-imidazol-1-ylcyclopentan-1-amine
CID 43734458
N-[(2-ethoxyphenyl)methyl]-2-imidazol-1-ylcyclopentan-1-amine
CID 43734305
N-(furan-3-ylmethyl)-2-methoxycyclopentan-1-amine
CID 63002147

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine?
The IUPAC name of N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine (CID 63204637) is N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine?
The canonical SMILES for N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine is c1cn(C2CCCC2NCc2ccoc2)cn1.
What is the InChIKey of N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine?
The InChIKey is GULGLHSMFGZNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-2-12(15-8-11-4-7-17-9-11)13(3-1)16-6-5-14-10-16/h4-7,9-10,12-13,15H,1-3,8H2.
What are the key properties of N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine?
N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine has a molecular weight of 231.30 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-2-imidazol-1-ylcyclopentan-1-amine is sourced from PubChem (CID 63204637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).