N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine

C14H27N — CID 105000647

IUPACN-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine
SMILESC=CC(NCC)C1(CC(C)C)CCCC1
InChIInChI=1S/C14H27N/c1-5-13(15-6-2)14(11-12(3)4)9-7-8-10-14/h5,12-13,15H,1,6-11H2,2-4H3
InChIKeyPEXYRDKRSFDBOT-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.76
Rot. Bonds6

About N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine

N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine (PubChem CID 105000647) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine.

Molecular Properties

Compound NameN-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine
PubChem CID105000647
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine
SMILESC=CC(NCC)C1(CC(C)C)CCCC1
InChIInChI=1S/C14H27N/c1-5-13(15-6-2)14(11-12(3)4)9-7-8-10-14/h5,12-13,15H,1,6-11H2,2-4H3
InChIKeyPEXYRDKRSFDBOT-UHFFFAOYSA-N
XLogP3.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.76
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

N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine
CID 115779478
N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-yn-1-amine
CID 104995383
N-ethyl-2-methyl-1-[1-(2-methylpropyl)cyclopentyl]pentan-1-amine
CID 107894025
N-ethyl-1-(1-methoxycyclobutyl)prop-2-en-1-amine
CID 116714475
1-but-3-en-2-yl-1-ethylcyclopentane;propane
CID 145053026
2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine
CID 105012642
N-ethyl-4-ethylsulfonyl-1-[1-(2-methylpropyl)cyclopentyl]butan-1-amine
CID 115865177
N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]-3-phenylpropan-1-amine
CID 115793603
N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]-2-(1,3-thiazol-5-yl)ethanamine
CID 105030313
1-[1-(2-methylpropyl)cyclopentyl]ethylhydrazine
CID 105282594
N-[[1-(2-methylpropyl)cyclopentyl]-pyridin-3-ylmethyl]ethanamine
CID 115799011
N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]-3-(oxolan-2-yl)propan-1-amine
CID 104993519

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine?
The IUPAC name of N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine (CID 105000647) is N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine.
What is the SMILES notation for N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine?
The canonical SMILES for N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine is C=CC(NCC)C1(CC(C)C)CCCC1.
What is the InChIKey of N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine?
The InChIKey is PEXYRDKRSFDBOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-5-13(15-6-2)14(11-12(3)4)9-7-8-10-14/h5,12-13,15H,1,6-11H2,2-4H3.
What are the key properties of N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine?
N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine has a molecular weight of 209.38 g/mol, XLogP of 3.76, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]prop-2-en-1-amine is sourced from PubChem (CID 105000647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).