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

C17H23N3O — CID 103538578

IUPACN-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine
SMILESCCNc1nc2ccccc2cc1CN1CCC(OC)C1
InChIInChI=1S/C17H23N3O/c1-3-18-17-14(11-20-9-8-15(12-20)21-2)10-13-6-4-5-7-16(13)19-17/h4-7,10,15H,3,8-9,11-12H2,1-2H3,(H,18,19)
InChIKeyVHNHZFWHDCWAAA-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.89
Rot. Bonds5

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

N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine (PubChem CID 103538578) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine
PubChem CID103538578
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine
SMILESCCNc1nc2ccccc2cc1CN1CCC(OC)C1
InChIInChI=1S/C17H23N3O/c1-3-18-17-14(11-20-9-8-15(12-20)21-2)10-13-6-4-5-7-16(13)19-17/h4-7,10,15H,3,8-9,11-12H2,1-2H3,(H,18,19)
InChIKeyVHNHZFWHDCWAAA-UHFFFAOYSA-N
XLogP2.89
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-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

3-[(3-methoxypiperidin-1-yl)methyl]-N-methylquinolin-2-amine
CID 102966730
3-[(4-methoxypiperidin-1-yl)methyl]-N-methylquinolin-2-amine
CID 62182388
1-[[2-(propylamino)quinolin-3-yl]methyl]pyrrolidin-3-ol
CID 62943784
N-ethyl-3-[(1-oxo-1,4-thiazinan-4-yl)methyl]quinolin-2-amine
CID 62182139
N-ethyl-3-propylquinolin-2-amine
CID 63232591
3-[[cyclopropyl(methyl)amino]methyl]-N-ethylquinolin-2-amine
CID 62182539
[3-[(4-methylpiperidin-1-yl)methyl]quinolin-2-yl]hydrazine
CID 62246122
2-[2-(3-methoxypyrrolidin-1-yl)quinolin-3-yl]ethanamine
CID 103540590
N-ethyl-2-[(3-methoxypyrrolidin-1-yl)methyl]-6-methylpyrimidin-4-amine
CID 103538592
4-[[2-(ethylamino)quinolin-3-yl]methyl]morpholin-3-one
CID 79468874
3-[(4,5-dimethylimidazol-1-yl)methyl]-N-ethylquinolin-2-amine
CID 62351315
N-ethyl-3-(3-methoxypropoxymethyl)quinolin-2-amine
CID 62195600

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine?
The IUPAC name of N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine (CID 103538578) is N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine.
What is the SMILES notation for N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine?
The canonical SMILES for N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine is CCNc1nc2ccccc2cc1CN1CCC(OC)C1.
What is the InChIKey of N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine?
The InChIKey is VHNHZFWHDCWAAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-18-17-14(11-20-9-8-15(12-20)21-2)10-13-6-4-5-7-16(13)19-17/h4-7,10,15H,3,8-9,11-12H2,1-2H3,(H,18,19).
What are the key properties of N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine?
N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine has a molecular weight of 285.39 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[(3-methoxypyrrolidin-1-yl)methyl]quinolin-2-amine is sourced from PubChem (CID 103538578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).