N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine

C13H16N4 — CID 106560493

IUPACN-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine
SMILESCc1cn(Cc2cccnc2)c(NC2CC2)n1
InChIInChI=1S/C13H16N4/c1-10-8-17(9-11-3-2-6-14-7-11)13(15-10)16-12-4-5-12/h2-3,6-8,12H,4-5,9H2,1H3,(H,15,16)
InChIKeyLXLTUNWWHKRQPP-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.21
Rot. Bonds4

About N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine

N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine (PubChem CID 106560493) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine
PubChem CID106560493
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC NameN-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine
SMILESCc1cn(Cc2cccnc2)c(NC2CC2)n1
InChIInChI=1S/C13H16N4/c1-10-8-17(9-11-3-2-6-14-7-11)13(15-10)16-12-4-5-12/h2-3,6-8,12H,4-5,9H2,1H3,(H,15,16)
InChIKeyLXLTUNWWHKRQPP-UHFFFAOYSA-N
XLogP2.21
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3-bromophenyl)methyl]-N-cyclopentyl-4-methylimidazol-2-amine
CID 106569126
N-cyclopentyl-1-[(3-fluorophenyl)methyl]-4-methylimidazol-2-amine
CID 106560946
1-[(5-chlorothiophen-2-yl)methyl]-N-cyclopropyl-4-methylimidazol-2-amine
CID 106575435
1-[(3-chloro-4-fluorophenyl)methyl]-N-cyclopentyl-4-methylimidazol-2-amine
CID 106570212
N-cyclopropyl-1-[2-[ethyl(methyl)amino]ethyl]-4-methylimidazol-2-amine
CID 106570435
N-(4-methylphenyl)-1-(pyridin-3-ylmethyl)piperidin-4-amine
CID 4040204
N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine
CID 106571990
N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine
CID 106579724
N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine
CID 106559095
N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106554952
N-cyclopropyl-1-isoquinolin-5-yl-4-methylimidazol-2-amine
CID 106562841
N-cyclopentyl-4-methyl-1-(2-pyrazol-1-ylethyl)imidazol-2-amine
CID 106568575

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine?
The IUPAC name of N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine (CID 106560493) is N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine is Cc1cn(Cc2cccnc2)c(NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine?
The InChIKey is LXLTUNWWHKRQPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-10-8-17(9-11-3-2-6-14-7-11)13(15-10)16-12-4-5-12/h2-3,6-8,12H,4-5,9H2,1H3,(H,15,16).
What are the key properties of N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine?
N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine has a molecular weight of 228.30 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methyl-1-(pyridin-3-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106560493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).