N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine

C11H17N3 — CID 130791747

IUPACN-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine
SMILESCn1cc(CNC2CC3CC3C2)cn1
InChIInChI=1S/C11H17N3/c1-14-7-8(6-13-14)5-12-11-3-9-2-10(9)4-11/h6-7,9-12H,2-5H2,1H3
InChIKeyBAJKIDIIJPLHCB-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.31
Rot. Bonds3

About N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine

N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine (PubChem CID 130791747) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine.

Molecular Properties

Compound NameN-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine
PubChem CID130791747
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC NameN-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine
SMILESCn1cc(CNC2CC3CC3C2)cn1
InChIInChI=1S/C11H17N3/c1-14-7-8(6-13-14)5-12-11-3-9-2-10(9)4-11/h6-7,9-12H,2-5H2,1H3
InChIKeyBAJKIDIIJPLHCB-UHFFFAOYSA-N
XLogP1.31
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1-methylpyrazol-4-yl)methyl]oxolan-3-amine
CID 63335876
2-methyl-N-[(1-methylpyrazol-4-yl)methyl]cyclobutan-1-amine
CID 130171522
N-[(1-methylpyrazol-4-yl)methyl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 61035182
N-[(1-methylpyrazol-4-yl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 60664575
N-[(1-methylpyrazol-4-yl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 61351170
2,3-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine
CID 64907975
1-(4-methylphenyl)sulfonyl-N-[(1-methylpyrazol-4-yl)methyl]piperidin-4-amine
CID 86772200
2,4,4-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]cyclopentan-1-amine
CID 106662388
N-[(1-methylpyrazol-4-yl)methyl]spiro[3.5]nonan-3-amine
CID 102951612
2-(chloromethyl)-N-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 106365328
2-tert-butyl-N-[(1-methylpyrazol-4-yl)methyl]cyclohexan-1-amine
CID 43673874
N-[(1-tert-butylpyrazol-4-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64722566

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine?
The IUPAC name of N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine (CID 130791747) is N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine.
What is the SMILES notation for N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine?
The canonical SMILES for N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine is Cn1cc(CNC2CC3CC3C2)cn1.
What is the InChIKey of N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine?
The InChIKey is BAJKIDIIJPLHCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-14-7-8(6-13-14)5-12-11-3-9-2-10(9)4-11/h6-7,9-12H,2-5H2,1H3.
What are the key properties of N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine?
N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine has a molecular weight of 191.28 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrazol-4-yl)methyl]bicyclo[3.1.0]hexan-3-amine is sourced from PubChem (CID 130791747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).