N,N'-dicyclopropyloctane-1,8-diamine

C14H28N2 — CID 66337537

IUPACN,N'-dicyclopropyloctane-1,8-diamine
SMILESC(CCCCNC1CC1)CCCNC1CC1
InChIInChI=1S/C14H28N2/c1(3-5-11-15-13-7-8-13)2-4-6-12-16-14-9-10-14/h13-16H,1-12H2
InChIKeySYXARMRQJVPLQR-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.83
Rot. Bonds11

About N,N'-dicyclopropyloctane-1,8-diamine

N,N'-dicyclopropyloctane-1,8-diamine (PubChem CID 66337537) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N,N'-dicyclopropyloctane-1,8-diamine.

Molecular Properties

Compound NameN,N'-dicyclopropyloctane-1,8-diamine
PubChem CID66337537
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN,N'-dicyclopropyloctane-1,8-diamine
SMILESC(CCCCNC1CC1)CCCNC1CC1
InChIInChI=1S/C14H28N2/c1(3-5-11-15-13-7-8-13)2-4-6-12-16-14-9-10-14/h13-16H,1-12H2
InChIKeySYXARMRQJVPLQR-UHFFFAOYSA-N
XLogP2.83
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-fluoropentyl)cyclopropanamine
CID 130516776
N,N'-dicyclohexyloctane-1,8-diamine;dihydrochloride
CID 3029604
N'-cyclopropyl-N-ethylheptane-1,7-diamine
CID 66321914
N-(8-trihydroxysilyloctyl)cyclopropanamine
CID 69079591
N'-tert-butyl-N-cyclopropyloctane-1,8-diamine
CID 66338082
N'-cyclopropylpropane-1,3-diamine
CID 44784906
N'-cyclopropyl-N-decylpropane-1,3-diamine
CID 113410376
N-(6-methylhept-6-enyl)cyclopropanamine
CID 114477275
N-decyl-4-ethylcyclohexan-1-amine
CID 63492402
N-cyclopropyl-N',N'-diethylpentane-1,5-diamine
CID 62438484
4-chloro-N-decylcyclohexan-1-amine
CID 65024074
4-chloro-N-hexylcyclohexan-1-amine
CID 65024365

Frequently Asked Questions

What is the IUPAC name of N,N'-dicyclopropyloctane-1,8-diamine?
The IUPAC name of N,N'-dicyclopropyloctane-1,8-diamine (CID 66337537) is N,N'-dicyclopropyloctane-1,8-diamine.
What is the SMILES notation for N,N'-dicyclopropyloctane-1,8-diamine?
The canonical SMILES for N,N'-dicyclopropyloctane-1,8-diamine is C(CCCCNC1CC1)CCCNC1CC1.
What is the InChIKey of N,N'-dicyclopropyloctane-1,8-diamine?
The InChIKey is SYXARMRQJVPLQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1(3-5-11-15-13-7-8-13)2-4-6-12-16-14-9-10-14/h13-16H,1-12H2.
What are the key properties of N,N'-dicyclopropyloctane-1,8-diamine?
N,N'-dicyclopropyloctane-1,8-diamine has a molecular weight of 224.39 g/mol, XLogP of 2.83, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclopropyloctane-1,8-diamine is sourced from PubChem (CID 66337537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).