N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine

C11H19N3 — CID 79358490

IUPACN-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
SMILESCC1(C)C(NCc2cnc[nH]2)C1(C)C
InChIInChI=1S/C11H19N3/c1-10(2)9(11(10,3)4)13-6-8-5-12-7-14-8/h5,7,9,13H,6H2,1-4H3,(H,12,14)
InChIKeyXUZQCWMZBZIDHO-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.93
Rot. Bonds3

About N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine

N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine (PubChem CID 79358490) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine.

Molecular Properties

Compound NameN-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
PubChem CID79358490
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
SMILESCC1(C)C(NCc2cnc[nH]2)C1(C)C
InChIInChI=1S/C11H19N3/c1-10(2)9(11(10,3)4)13-6-8-5-12-7-14-8/h5,7,9,13H,6H2,1-4H3,(H,12,14)
InChIKeyXUZQCWMZBZIDHO-UHFFFAOYSA-N
XLogP1.93
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-imidazol-5-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine
CID 55109451
1-(1H-imidazol-5-yl)-N-methylmethanamine
CID 20675588
1-(1H-imidazol-5-yl)-N-[(1-methylcyclopropyl)methyl]methanamine
CID 103724271
N-(1H-imidazol-5-ylmethyl)-6-methylpiperidin-3-amine
CID 131219532
N-(1H-imidazol-5-ylmethyl)-1-(1-methylcyclopropyl)ethanamine
CID 63000739
N-(1H-imidazol-5-ylmethyl)prop-2-yn-1-amine
CID 62762970
4-(1H-imidazol-5-ylmethylamino)-1-methylpyrrolidin-2-one
CID 130804951
N-(1H-imidazol-5-ylmethyl)-1-propylsulfonylpiperidin-4-amine
CID 62761764
5-(1H-imidazol-5-ylmethylamino)-1-methylpiperidin-2-one
CID 64655747
(1R)-N-(1H-imidazol-5-ylmethyl)-1-phenylethanamine
CID 63714042
N-[2-(1H-imidazol-5-yl)ethyl]-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658816
N-(1H-imidazol-5-ylmethyl)-3-(2-methylpropyl)cyclohexan-1-amine
CID 107428555

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
The IUPAC name of N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine (CID 79358490) is N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine.
What is the SMILES notation for N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
The canonical SMILES for N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine is CC1(C)C(NCc2cnc[nH]2)C1(C)C.
What is the InChIKey of N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
The InChIKey is XUZQCWMZBZIDHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-10(2)9(11(10,3)4)13-6-8-5-12-7-14-8/h5,7,9,13H,6H2,1-4H3,(H,12,14).
What are the key properties of N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine?
N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine has a molecular weight of 193.29 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-5-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine is sourced from PubChem (CID 79358490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).