N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine

C13H23N3 — CID 106580220

IUPACN-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine
SMILESCCCn1cc(C)nc1NCC(C)C1CC1
InChIInChI=1S/C13H23N3/c1-4-7-16-9-11(3)15-13(16)14-8-10(2)12-5-6-12/h9-10,12H,4-8H2,1-3H3,(H,14,15)
InChIKeyLDBVXRMFERHJBZ-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.06
Rot. Bonds6

About N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine

N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine (PubChem CID 106580220) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine
PubChem CID106580220
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine
SMILESCCCn1cc(C)nc1NCC(C)C1CC1
InChIInChI=1S/C13H23N3/c1-4-7-16-9-11(3)15-13(16)14-8-10(2)12-5-6-12/h9-10,12H,4-8H2,1-3H3,(H,14,15)
InChIKeyLDBVXRMFERHJBZ-UHFFFAOYSA-N
XLogP3.06
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopropylpropyl)-1,4-dimethylimidazol-2-amine
CID 106580212
1-(2-cyclopropylpropyl)-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106580222
N-(2-cyclobutylethyl)-4-methyl-1-propylimidazol-2-amine
CID 106580756
4-methyl-1-propyl-N-(thian-4-yl)imidazol-2-amine
CID 106582146
4-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]-1-propylimidazol-2-amine
CID 106581942
N-cyclooctyl-4-methyl-1-propylimidazol-2-amine
CID 106557173
1-ethyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106554987
4-methyl-1-(3-methylbutyl)-N-propylimidazol-2-amine
CID 106557292
4-methyl-N-(3-methylcyclopentyl)-1-propylimidazol-2-amine
CID 106581853
4-methyl-N-(2-methylpropyl)-1-(thian-4-ylmethyl)imidazol-2-amine
CID 106580072
4-methyl-1-[(1-methylpiperidin-4-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine
CID 106567072
4-methyl-N-(1-methylsulfanylpropan-2-yl)-1-propylimidazol-2-amine
CID 106581346

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine?
The IUPAC name of N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine (CID 106580220) is N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine.
What is the SMILES notation for N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine?
The canonical SMILES for N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine is CCCn1cc(C)nc1NCC(C)C1CC1.
What is the InChIKey of N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine?
The InChIKey is LDBVXRMFERHJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-4-7-16-9-11(3)15-13(16)14-8-10(2)12-5-6-12/h9-10,12H,4-8H2,1-3H3,(H,14,15).
What are the key properties of N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine?
N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine has a molecular weight of 221.35 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-4-methyl-1-propylimidazol-2-amine is sourced from PubChem (CID 106580220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).