2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline

C17H20N2 — CID 174283470

IUPAC2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline
SMILESc1cc2nc(C3CC3)ccc2cc1CN1CCCC1
InChIInChI=1S/C17H20N2/c1-2-10-19(9-1)12-13-3-7-17-15(11-13)6-8-16(18-17)14-4-5-14/h3,6-8,11,14H,1-2,4-5,9-10,12H2
InChIKeyFTMSHSPZHTWZHX-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.71
Rot. Bonds3

About 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline

2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline (PubChem CID 174283470) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline.

Molecular Properties

Compound Name2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline
PubChem CID174283470
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline
SMILESc1cc2nc(C3CC3)ccc2cc1CN1CCCC1
InChIInChI=1S/C17H20N2/c1-2-10-19(9-1)12-13-3-7-17-15(11-13)6-8-16(18-17)14-4-5-14/h3,6-8,11,14H,1-2,4-5,9-10,12H2
InChIKeyFTMSHSPZHTWZHX-UHFFFAOYSA-N
XLogP3.71
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-6-(pyrrolidin-1-ylmethyl)quinoline
CID 174283618
3-hydroxy-1-[[2-(oxan-4-yl)quinolin-6-yl]methyl]pyrrolidin-2-one
CID 174207046
2-(1-methylpiperidin-4-yl)-6-(pyrrolidin-1-ylmethyl)quinazoline
CID 174284496
N-methyl-1-[(2-methylquinolin-6-yl)methyl]piperidin-3-amine
CID 105378976
6-[(3-methoxypiperidin-1-yl)methyl]-2-methylquinoline
CID 126778484
2-cyclopropylquinoline-6-carboxylic acid;hydrochloride
CID 86664097
2-methoxy-6-(pyrrolidin-1-ylmethyl)quinazoline
CID 174283606
2-methyl-6-[(3-methylpyrrolidin-1-yl)methyl]quinoline
CID 170707754
6-[[3-[4-methyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]quinoline
CID 119075050
6-[[(3R)-3-[4-methyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]quinoline
CID 126454219
[2-[(1S,3S)-3-methoxycyclopentyl]quinolin-6-yl]methanol;[2-(3-methoxycyclopentyl)quinolin-6-yl]methanol
CID 176888185
N-(cyclopropylmethyl)-1-[(2-methylquinolin-6-yl)methyl]piperidin-4-amine;hydrochloride
CID 120841570

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline?
The IUPAC name of 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline (CID 174283470) is 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline.
What is the SMILES notation for 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline?
The canonical SMILES for 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline is c1cc2nc(C3CC3)ccc2cc1CN1CCCC1.
What is the InChIKey of 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline?
The InChIKey is FTMSHSPZHTWZHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-2-10-19(9-1)12-13-3-7-17-15(11-13)6-8-16(18-17)14-4-5-14/h3,6-8,11,14H,1-2,4-5,9-10,12H2.
What are the key properties of 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline?
2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline has a molecular weight of 252.36 g/mol, XLogP of 3.71, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline is sourced from PubChem (CID 174283470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).