N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine

C14H28N2O — CID 43591816

IUPACN'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine
SMILESNCCCN(CC1CCCCO1)C1CCCC1
InChIInChI=1S/C14H28N2O/c15-9-5-10-16(13-6-1-2-7-13)12-14-8-3-4-11-17-14/h13-14H,1-12,15H2
InChIKeyNRGIFZRZFHZCIL-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.15
Rot. Bonds6

About N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine

N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine (PubChem CID 43591816) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine
PubChem CID43591816
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine
SMILESNCCCN(CC1CCCCO1)C1CCCC1
InChIInChI=1S/C14H28N2O/c15-9-5-10-16(13-6-1-2-7-13)12-14-8-3-4-11-17-14/h13-14H,1-12,15H2
InChIKeyNRGIFZRZFHZCIL-UHFFFAOYSA-N
XLogP2.15
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloroethyl)-N-(oxan-2-ylmethyl)cyclopentanamine
CID 63389279
N'-cyclohexyl-N'-[2-(oxolan-2-yl)ethyl]propane-1,3-diamine
CID 65158410
3-[cyclopentyl(oxolan-2-ylmethyl)amino]propan-1-ol
CID 111488864
N-(2-chloroethyl)-N-(oxan-2-ylmethyl)cyclohexanamine
CID 63386966
N'-cyclopentyl-N'-[(4-methylmorpholin-2-yl)methyl]propane-1,3-diamine
CID 79172179
N-(2-chloroethyl)-N-(oxolan-2-ylmethyl)cyclopentanamine
CID 63388993
N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine
CID 61344091
N'-cyclohexyl-N'-[3-(oxolan-2-yl)propyl]ethane-1,2-diamine
CID 65165454
N'-cyclobutyl-N'-(cyclobutylmethyl)propane-1,3-diamine
CID 102875057
N-(3-aminopropyl)-N-cyclobutyl-2-(oxan-2-yl)acetamide
CID 102873969
N'-cyclopentyl-N'-(1-oxaspiro[4.4]nonan-2-ylmethyl)propane-1,3-diamine
CID 102896430
N'-cyclopentyl-N'-[2-(oxolan-2-yl)ethyl]ethane-1,2-diamine
CID 65158903

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine?
The IUPAC name of N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine (CID 43591816) is N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine is NCCCN(CC1CCCCO1)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine?
The InChIKey is NRGIFZRZFHZCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c15-9-5-10-16(13-6-1-2-7-13)12-14-8-3-4-11-17-14/h13-14H,1-12,15H2.
What are the key properties of N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine?
N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine has a molecular weight of 240.39 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine is sourced from PubChem (CID 43591816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).