N-hexan-3-yl-N-propylcyclopentanamine

C14H29N — CID 130409572

IUPACN-hexan-3-yl-N-propylcyclopentanamine
SMILESCCCC(CC)N(CCC)C1CCCC1
InChIInChI=1S/C14H29N/c1-4-9-13(6-3)15(12-5-2)14-10-7-8-11-14/h13-14H,4-12H2,1-3H3
InChIKeyMVYCPGLENWIMCW-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.22
Rot. Bonds7

About N-hexan-3-yl-N-propylcyclopentanamine

N-hexan-3-yl-N-propylcyclopentanamine (PubChem CID 130409572) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-hexan-3-yl-N-propylcyclopentanamine.

Molecular Properties

Compound NameN-hexan-3-yl-N-propylcyclopentanamine
PubChem CID130409572
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-hexan-3-yl-N-propylcyclopentanamine
SMILESCCCC(CC)N(CCC)C1CCCC1
InChIInChI=1S/C14H29N/c1-4-9-13(6-3)15(12-5-2)14-10-7-8-11-14/h13-14H,4-12H2,1-3H3
InChIKeyMVYCPGLENWIMCW-UHFFFAOYSA-N
XLogP4.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-hexan-3-yl-N-propylcyclopentanamine?
The IUPAC name of N-hexan-3-yl-N-propylcyclopentanamine (CID 130409572) is N-hexan-3-yl-N-propylcyclopentanamine.
What is the SMILES notation for N-hexan-3-yl-N-propylcyclopentanamine?
The canonical SMILES for N-hexan-3-yl-N-propylcyclopentanamine is CCCC(CC)N(CCC)C1CCCC1.
What is the InChIKey of N-hexan-3-yl-N-propylcyclopentanamine?
The InChIKey is MVYCPGLENWIMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-4-9-13(6-3)15(12-5-2)14-10-7-8-11-14/h13-14H,4-12H2,1-3H3.
What are the key properties of N-hexan-3-yl-N-propylcyclopentanamine?
N-hexan-3-yl-N-propylcyclopentanamine has a molecular weight of 211.39 g/mol, XLogP of 4.22, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexan-3-yl-N-propylcyclopentanamine is sourced from PubChem (CID 130409572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).