2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine

C14H25N3 — CID 66161855

IUPAC2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine
SMILESCC(C)n1cncc1C1CC1CNC(C)(C)C
InChIInChI=1S/C14H25N3/c1-10(2)17-9-15-8-13(17)12-6-11(12)7-16-14(3,4)5/h8-12,16H,6-7H2,1-5H3
InChIKeyMRDFINXVPVVAJN-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.96
Rot. Bonds4

About 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine

2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine (PubChem CID 66161855) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine
PubChem CID66161855
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine
SMILESCC(C)n1cncc1C1CC1CNC(C)(C)C
InChIInChI=1S/C14H25N3/c1-10(2)17-9-15-8-13(17)12-6-11(12)7-16-14(3,4)5/h8-12,16H,6-7H2,1-5H3
InChIKeyMRDFINXVPVVAJN-UHFFFAOYSA-N
XLogP2.96
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[2-(3-methylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine
CID 66116512
5-[2-(chloromethyl)cyclopropyl]-1-propan-2-ylimidazole
CID 81358333
N-[[2-(3-methylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine
CID 66116304
2-methyl-N-[(2-pyridin-4-ylcyclopropyl)methyl]propan-2-amine
CID 62713515
2-methyl-N-[[2-(3-propylimidazol-4-yl)cyclopropyl]methyl]propan-1-amine
CID 66132443
[2-(3-propan-2-ylimidazol-4-yl)oxolan-3-yl]methanamine
CID 79368224
2-methyl-N-[(2-pyridin-2-ylcyclopropyl)methyl]propan-2-amine
CID 62712988
2-(3-propan-2-ylimidazol-4-yl)oxolan-3-amine
CID 79365132
[1-cyclopropyl-2-(3-propan-2-ylimidazol-4-yl)pyrrolidin-3-yl]methanamine
CID 66163581
N-[[2-(3-cyclopropylimidazol-4-yl)cyclopropyl]methyl]ethanamine
CID 66140268
N-[[1-methyl-2-(3-propan-2-ylimidazol-4-yl)pyrrolidin-3-yl]methyl]propan-1-amine
CID 66161976
2-methyl-N-[[2-(3-propylimidazol-4-yl)oxolan-3-yl]methyl]propan-2-amine
CID 79367798

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine (CID 66161855) is 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine is CC(C)n1cncc1C1CC1CNC(C)(C)C.
What is the InChIKey of 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine?
The InChIKey is MRDFINXVPVVAJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-10(2)17-9-15-8-13(17)12-6-11(12)7-16-14(3,4)5/h8-12,16H,6-7H2,1-5H3.
What are the key properties of 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine?
2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine has a molecular weight of 235.38 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(3-propan-2-ylimidazol-4-yl)cyclopropyl]methyl]propan-2-amine is sourced from PubChem (CID 66161855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).