N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine

C18H25N3 — CID 63314495

IUPACN'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine
SMILESCN(CCNCc1cccc2cccnc12)C1CCCC1
InChIInChI=1S/C18H25N3/c1-21(17-9-2-3-10-17)13-12-19-14-16-7-4-6-15-8-5-11-20-18(15)16/h4-8,11,17,19H,2-3,9-10,12-14H2,1H3
InChIKeyGNQGPCJNWSGALR-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.20
Rot. Bonds6

About N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine

N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine (PubChem CID 63314495) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine
PubChem CID63314495
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine
SMILESCN(CCNCc1cccc2cccnc12)C1CCCC1
InChIInChI=1S/C18H25N3/c1-21(17-9-2-3-10-17)13-12-19-14-16-7-4-6-15-8-5-11-20-18(15)16/h4-8,11,17,19H,2-3,9-10,12-14H2,1H3
InChIKeyGNQGPCJNWSGALR-UHFFFAOYSA-N
XLogP3.20
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
CID 43298300
2-[[2-[cyclopentyl(methyl)amino]ethylamino]methyl]phenol
CID 63314661
N'-cyclopentyl-N-[(2,3-difluorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 63318484
N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine
CID 105415743
2-[[2-[cyclopentyl(methyl)amino]ethylamino]methyl]-6-methylphenol
CID 112554689
N-(quinolin-8-ylmethyl)butan-1-amine
CID 28613793
N'-cyclopropyl-N'-methyl-N-(naphthalen-1-ylmethyl)ethane-1,2-diamine
CID 62975885
2-chloro-6-[[2-[cyclopentyl(methyl)amino]ethylamino]methyl]phenol
CID 112554690
2-(4-methylpiperidin-1-yl)-N-(quinolin-8-ylmethyl)ethanamine
CID 61239909
N'-cyclopentyl-N'-methyl-N-(1H-pyrazol-5-ylmethyl)ethane-1,2-diamine
CID 63314803
2,6-dimethyl-N-(quinolin-8-ylmethyl)piperidin-1-amine
CID 83007197
3-fluoro-N-(quinolin-8-ylmethyl)propan-1-amine
CID 81435594

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine (CID 63314495) is N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine is CN(CCNCc1cccc2cccnc12)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine?
The InChIKey is GNQGPCJNWSGALR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-21(17-9-2-3-10-17)13-12-19-14-16-7-4-6-15-8-5-11-20-18(15)16/h4-8,11,17,19H,2-3,9-10,12-14H2,1H3.
What are the key properties of N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine?
N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine has a molecular weight of 283.42 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 63314495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).