3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine

C16H21N3 — CID 106027080

IUPAC3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine
SMILESCc1cc2ccccc2nc1NCC1CCCN1C
InChIInChI=1S/C16H21N3/c1-12-10-13-6-3-4-8-15(13)18-16(12)17-11-14-7-5-9-19(14)2/h3-4,6,8,10,14H,5,7,9,11H2,1-2H3,(H,17,18)
InChIKeyWLIINWJTFVRTSC-UHFFFAOYSA-N
MW255.37 g/mol
LogP3.05
Rot. Bonds3

About 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine

3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine (PubChem CID 106027080) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine.

Molecular Properties

Compound Name3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine
PubChem CID106027080
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine
SMILESCc1cc2ccccc2nc1NCC1CCCN1C
InChIInChI=1S/C16H21N3/c1-12-10-13-6-3-4-8-15(13)18-16(12)17-11-14-7-5-9-19(14)2/h3-4,6,8,10,14H,5,7,9,11H2,1-2H3,(H,17,18)
InChIKeyWLIINWJTFVRTSC-UHFFFAOYSA-N
XLogP3.05
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-[(2-methylcyclopentyl)methyl]quinolin-2-amine
CID 107419147
2-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]quinazolin-4-amine
CID 106028358
N-[(4-ethylcyclohexyl)methyl]-3-methylquinolin-2-amine
CID 63535077
3-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]quinolin-2-amine
CID 63229429
1-[(2S)-1-methylpyrrolidin-2-yl]-N-(quinolin-2-ylmethyl)methanamine
CID 58622263
N-[(1,1-dioxothiolan-3-yl)methyl]-3-methylquinolin-2-amine
CID 45214315
N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-3-methylquinolin-2-amine
CID 63229349
3-chloro-5,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazin-2-amine
CID 106028253
2,5-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]aniline
CID 83962534
3,5-difluoro-6-hydrazinyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine
CID 106026111
1-cyclopropyl-2-[(3-methylquinolin-2-yl)amino]ethanol
CID 63296727
N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-3-methylquinolin-2-amine
CID 71968315

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine?
The IUPAC name of 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine (CID 106027080) is 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine.
What is the SMILES notation for 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine?
The canonical SMILES for 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine is Cc1cc2ccccc2nc1NCC1CCCN1C.
What is the InChIKey of 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine?
The InChIKey is WLIINWJTFVRTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-12-10-13-6-3-4-8-15(13)18-16(12)17-11-14-7-5-9-19(14)2/h3-4,6,8,10,14H,5,7,9,11H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine?
3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine has a molecular weight of 255.37 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]quinolin-2-amine is sourced from PubChem (CID 106027080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).