1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine

C14H20N4 — CID 63378842

IUPAC1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine
SMILESCN1CCC(NCc2nn(C)c3ccccc23)C1
InChIInChI=1S/C14H20N4/c1-17-8-7-11(10-17)15-9-13-12-5-3-4-6-14(12)18(2)16-13/h3-6,11,15H,7-10H2,1-2H3
InChIKeyQHFNMYGLPNHBEZ-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.37
Rot. Bonds3

About 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine

1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine (PubChem CID 63378842) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine
PubChem CID63378842
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine
SMILESCN1CCC(NCc2nn(C)c3ccccc23)C1
InChIInChI=1S/C14H20N4/c1-17-8-7-11(10-17)15-9-13-12-5-3-4-6-14(12)18(2)16-13/h3-6,11,15H,7-10H2,1-2H3
InChIKeyQHFNMYGLPNHBEZ-UHFFFAOYSA-N
XLogP1.37
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-methylindazol-3-yl)methyl]cyclopent-3-en-1-amine
CID 113256963
N-[(1-methylindazol-3-yl)methyl]oxolan-3-amine
CID 80713493
3-(cyclopropylmethyl)-1-methylindazole
CID 142276732
N-[(1-methylindazol-3-yl)methyl]-2-methylsulfanylcyclopentan-1-amine
CID 103701231
N-[3-methyl-4-(1-methylindazol-3-yl)butyl]cyclopropanamine
CID 81018955
1,1-dicyclopropyl-N-[(1-methylindazol-3-yl)methyl]methanamine
CID 63001612
2-[(1-methylindazol-3-yl)methylamino]-2,3-dihydro-1H-indene-5-carboxylic acid
CID 166268035
N-methyl-1-(1-methylindazol-3-yl)methanamine;hydrochloride
CID 131083250
N-[(1-methylindazol-3-yl)methyl]-1-(oxan-4-yl)methanamine
CID 63000865
N-cyclopentyloxy-1-(1-methylindazol-3-yl)methanamine
CID 83235470
N-(1-benzofuran-2-ylmethyl)-1-methylpyrrolidin-3-amine
CID 54950067
N-[(5-ethylfuran-2-yl)methyl]-1-methylpyrrolidin-3-amine
CID 62344751

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine?
The IUPAC name of 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine (CID 63378842) is 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine.
What is the SMILES notation for 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine?
The canonical SMILES for 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine is CN1CCC(NCc2nn(C)c3ccccc23)C1.
What is the InChIKey of 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine?
The InChIKey is QHFNMYGLPNHBEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-17-8-7-11(10-17)15-9-13-12-5-3-4-6-14(12)18(2)16-13/h3-6,11,15H,7-10H2,1-2H3.
What are the key properties of 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine?
1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine has a molecular weight of 244.34 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(1-methylindazol-3-yl)methyl]pyrrolidin-3-amine is sourced from PubChem (CID 63378842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).