1-tert-butylcyclopentan-1-amine

C9H19N — CID 19752059

IUPAC1-tert-butylcyclopentan-1-amine
SMILESCC(C)(C)C1(N)CCCC1
InChIInChI=1S/C9H19N/c1-8(2,3)9(10)6-4-5-7-9/h4-7,10H2,1-3H3
InChIKeyQFAHFXWSZSMSOJ-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.30
Rot. Bonds

About 1-tert-butylcyclopentan-1-amine

1-tert-butylcyclopentan-1-amine (PubChem CID 19752059) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 1-tert-butylcyclopentan-1-amine.

Molecular Properties

Compound Name1-tert-butylcyclopentan-1-amine
PubChem CID19752059
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name1-tert-butylcyclopentan-1-amine
SMILESCC(C)(C)C1(N)CCCC1
InChIInChI=1S/C9H19N/c1-8(2,3)9(10)6-4-5-7-9/h4-7,10H2,1-3H3
InChIKeyQFAHFXWSZSMSOJ-UHFFFAOYSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butylcyclopentan-1-amine?
The IUPAC name of 1-tert-butylcyclopentan-1-amine (CID 19752059) is 1-tert-butylcyclopentan-1-amine.
What is the SMILES notation for 1-tert-butylcyclopentan-1-amine?
The canonical SMILES for 1-tert-butylcyclopentan-1-amine is CC(C)(C)C1(N)CCCC1.
What is the InChIKey of 1-tert-butylcyclopentan-1-amine?
The InChIKey is QFAHFXWSZSMSOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-8(2,3)9(10)6-4-5-7-9/h4-7,10H2,1-3H3.
What are the key properties of 1-tert-butylcyclopentan-1-amine?
1-tert-butylcyclopentan-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butylcyclopentan-1-amine is sourced from PubChem (CID 19752059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).