2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine

C13H25N — CID 105005477

IUPAC2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine
SMILESC=C(C)C(NCCC)C1(C)CCCC1
InChIInChI=1S/C13H25N/c1-5-10-14-12(11(2)3)13(4)8-6-7-9-13/h12,14H,2,5-10H2,1,3-4H3
InChIKeyHRYNYRKKKCOMNG-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.51
Rot. Bonds5

About 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine

2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine (PubChem CID 105005477) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine.

Molecular Properties

Compound Name2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine
PubChem CID105005477
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine
SMILESC=C(C)C(NCCC)C1(C)CCCC1
InChIInChI=1S/C13H25N/c1-5-10-14-12(11(2)3)13(4)8-6-7-9-13/h12,14H,2,5-10H2,1,3-4H3
InChIKeyHRYNYRKKKCOMNG-UHFFFAOYSA-N
XLogP3.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.51
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

1-(1-adamantyl)-2-methyl-N-propylprop-2-en-1-amine
CID 79189871
1-(2,2-dimethylcyclopropyl)-2-methyl-N-propylprop-2-en-1-amine
CID 107004692
1-(1-methoxy-4-methylcyclohexyl)-2-methyl-N-propylprop-2-en-1-amine
CID 116766773
2-methyl-1-(1-phenylcyclopropyl)-N-propylprop-2-en-1-amine
CID 79177489
4-methyl-1-(1-methylcyclopentyl)-N-propylpentan-1-amine
CID 115834516
3-methyl-N-propylbut-3-en-2-amine
CID 79177488
1-(1,3-dioxolan-2-yl)-3-methyl-N-propylbut-3-en-2-amine
CID 103546934
1-(1-methylcyclopentyl)-N-propyldecan-1-amine
CID 115831669
1-(1-methoxycyclopentyl)-3-methyl-N-propylbut-3-en-1-amine
CID 104611348
1-(1-methylcyclopentyl)-N-propylpent-3-yn-1-amine
CID 115819864
[1-(1-ethylcyclopentyl)-2-methylprop-2-enyl]hydrazine
CID 105320113
1-(1-methylcyclohexyl)-1-(prop-1-en-2-ylamino)propan-2-one
CID 143353919

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine?
The IUPAC name of 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine (CID 105005477) is 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine.
What is the SMILES notation for 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine?
The canonical SMILES for 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine is C=C(C)C(NCCC)C1(C)CCCC1.
What is the InChIKey of 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine?
The InChIKey is HRYNYRKKKCOMNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-5-10-14-12(11(2)3)13(4)8-6-7-9-13/h12,14H,2,5-10H2,1,3-4H3.
What are the key properties of 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine?
2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(1-methylcyclopentyl)-N-propylprop-2-en-1-amine is sourced from PubChem (CID 105005477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).