N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine

C18H34N2 — CID 81384136

IUPACN-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESC[C@@H](NC1CCCC1C1CCCCN1)C1CCCCC1
InChIInChI=1S/C18H34N2/c1-14(15-8-3-2-4-9-15)20-18-12-7-10-16(18)17-11-5-6-13-19-17/h14-20H,2-13H2,1H3/t14-,16?,17?,18?/m1/s1
InChIKeyYHNNJBVZYISJMF-UWIAJVCOSA-N
MW278.48 g/mol
LogP3.86
Rot. Bonds4

About N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine

N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine (PubChem CID 81384136) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine
PubChem CID81384136
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC NameN-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESC[C@@H](NC1CCCC1C1CCCCN1)C1CCCCC1
InChIInChI=1S/C18H34N2/c1-14(15-8-3-2-4-9-15)20-18-12-7-10-16(18)17-11-5-6-13-19-17/h14-20H,2-13H2,1H3/t14-,16?,17?,18?/m1/s1
InChIKeyYHNNJBVZYISJMF-UWIAJVCOSA-N
XLogP3.86
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine?
The IUPAC name of N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine (CID 81384136) is N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine.
What is the SMILES notation for N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine?
The canonical SMILES for N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine is C[C@@H](NC1CCCC1C1CCCCN1)C1CCCCC1.
What is the InChIKey of N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine?
The InChIKey is YHNNJBVZYISJMF-UWIAJVCOSA-N. The full InChI is InChI=1S/C18H34N2/c1-14(15-8-3-2-4-9-15)20-18-12-7-10-16(18)17-11-5-6-13-19-17/h14-20H,2-13H2,1H3/t14-,16?,17?,18?/m1/s1.
What are the key properties of N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine?
N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine has a molecular weight of 278.48 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclohexylethyl]-2-piperidin-2-ylcyclopentan-1-amine is sourced from PubChem (CID 81384136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).