N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine

C11H19N3 — CID 103735396

IUPACN-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine
SMILESCCC1(CNCc2ccnn2C)CC1
InChIInChI=1S/C11H19N3/c1-3-11(5-6-11)9-12-8-10-4-7-13-14(10)2/h4,7,12H,3,5-6,8-9H2,1-2H3
InChIKeyYJDMVOMPIBWTCY-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.70
Rot. Bonds5

About N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine

N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine (PubChem CID 103735396) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine.

Molecular Properties

Compound NameN-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine
PubChem CID103735396
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine
SMILESCCC1(CNCc2ccnn2C)CC1
InChIInChI=1S/C11H19N3/c1-3-11(5-6-11)9-12-8-10-4-7-13-14(10)2/h4,7,12H,3,5-6,8-9H2,1-2H3
InChIKeyYJDMVOMPIBWTCY-UHFFFAOYSA-N
XLogP1.70
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-cyclopropylcyclobutyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine
CID 115757332
1-[(1-ethylcyclobutyl)methyl]-2-methyl-3-[(2-methylpyrazol-3-yl)methyl]guanidine
CID 109470066
2-methyl-3-[[(2-methylpyrazol-3-yl)methylamino]methyl]oxolan-3-ol
CID 107268404
1-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]methanamine
CID 43663124
N-[[1-[2-(2-methylpyrazol-3-yl)ethyl]cyclohexyl]methyl]propan-1-amine
CID 103014466
N-[[1-[2-(2-methylpyrazol-3-yl)ethyl]cyclopropyl]methyl]propan-2-amine
CID 103014617
N-[(3-ethoxy-1-morpholin-4-ylcyclobutyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine
CID 99844458
N-[[4-[2-(2-methylpyrazol-3-yl)ethyl]oxan-4-yl]methyl]propan-1-amine
CID 103014575
N-[(1-ethylcyclopropyl)methyl]-1-pyridin-2-ylmethanamine
CID 103735456
1-(1-ethylpyrrol-3-yl)-N-[(2-methylpyrazol-3-yl)methyl]methanamine
CID 66414611
N-[(2-methylpyrazol-3-yl)methyl]-1-pyridin-4-ylmethanamine
CID 19626583
2,2,2-trifluoro-N-[(2-methylpyrazol-3-yl)methyl]ethanamine
CID 43663111

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine?
The IUPAC name of N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine (CID 103735396) is N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine.
What is the SMILES notation for N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine?
The canonical SMILES for N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine is CCC1(CNCc2ccnn2C)CC1.
What is the InChIKey of N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine?
The InChIKey is YJDMVOMPIBWTCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-11(5-6-11)9-12-8-10-4-7-13-14(10)2/h4,7,12H,3,5-6,8-9H2,1-2H3.
What are the key properties of N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine?
N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine has a molecular weight of 193.29 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclopropyl)methyl]-1-(2-methylpyrazol-3-yl)methanamine is sourced from PubChem (CID 103735396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).