1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine

C16H34N2 — CID 82922550

IUPAC1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine
SMILESCCC(CC)CC(N)C1(N(CC)CC)CCCC1
InChIInChI=1S/C16H34N2/c1-5-14(6-2)13-15(17)16(11-9-10-12-16)18(7-3)8-4/h14-15H,5-13,17H2,1-4H3
InChIKeyCTPKSAKHGUBWRG-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.79
Rot. Bonds8

About 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine

1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine (PubChem CID 82922550) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine
PubChem CID82922550
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine
SMILESCCC(CC)CC(N)C1(N(CC)CC)CCCC1
InChIInChI=1S/C16H34N2/c1-5-14(6-2)13-15(17)16(11-9-10-12-16)18(7-3)8-4/h14-15H,5-13,17H2,1-4H3
InChIKeyCTPKSAKHGUBWRG-UHFFFAOYSA-N
XLogP3.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine?
The IUPAC name of 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine (CID 82922550) is 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine.
What is the SMILES notation for 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine?
The canonical SMILES for 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine is CCC(CC)CC(N)C1(N(CC)CC)CCCC1.
What is the InChIKey of 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine?
The InChIKey is CTPKSAKHGUBWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-5-14(6-2)13-15(17)16(11-9-10-12-16)18(7-3)8-4/h14-15H,5-13,17H2,1-4H3.
What are the key properties of 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine?
1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.79, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-3-ethylpentyl)-N,N-diethylcyclopentan-1-amine is sourced from PubChem (CID 82922550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).