1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine

C15H29N — CID 107189799

IUPAC1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine
SMILESC=C(CC)CC(NCCC)C1CCCC1C
InChIInChI=1S/C15H29N/c1-5-10-16-15(11-12(3)6-2)14-9-7-8-13(14)4/h13-16H,3,5-11H2,1-2,4H3
InChIKeyYJQSMWNAJDOZCA-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.15
Rot. Bonds7

About 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine

1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine (PubChem CID 107189799) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine
PubChem CID107189799
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine
SMILESC=C(CC)CC(NCCC)C1CCCC1C
InChIInChI=1S/C15H29N/c1-5-10-16-15(11-12(3)6-2)14-9-7-8-13(14)4/h13-16H,3,5-11H2,1-2,4H3
InChIKeyYJQSMWNAJDOZCA-UHFFFAOYSA-N
XLogP4.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-methyl-1-(2-methylcyclopentyl)-N-propylbut-3-en-1-amine
CID 107189757
3-methylidene-N-propyl-1-(thiolan-2-yl)pentan-1-amine
CID 80626543
3-methylidene-1-(oxolan-2-yl)-N-propylpentan-1-amine
CID 66037811
3-methylidene-N-propyl-1-(thian-2-yl)pentan-1-amine
CID 80627297
5,5,5-trifluoro-1-(2-methylcyclopentyl)-N-propylpentan-1-amine
CID 107190458
3-methylidene-N-propyl-1-[3-(trifluoromethyl)cyclohexyl]pentan-1-amine
CID 105163942
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-3-methylidene-N-propylpentan-1-amine
CID 105005744
1-(2,3-dihydro-1H-inden-1-yl)-3-methylidene-N-propylpentan-1-amine
CID 66039008
N-[2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethyl]propan-1-amine
CID 107190842
1-(1,4-dithian-2-yl)-3-methylidene-N-propylpentan-1-amine
CID 79966723
N-[2-(2,5-difluorophenyl)-1-(2-methylcyclopentyl)ethyl]propan-1-amine
CID 107187960
N-[2-(2,3-dichlorophenyl)-1-(2-methylcyclopentyl)ethyl]propan-1-amine
CID 107312289

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine?
The IUPAC name of 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine (CID 107189799) is 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine.
What is the SMILES notation for 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine?
The canonical SMILES for 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine is C=C(CC)CC(NCCC)C1CCCC1C.
What is the InChIKey of 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine?
The InChIKey is YJQSMWNAJDOZCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-5-10-16-15(11-12(3)6-2)14-9-7-8-13(14)4/h13-16H,3,5-11H2,1-2,4H3.
What are the key properties of 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine?
1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-3-methylidene-N-propylpentan-1-amine is sourced from PubChem (CID 107189799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).