3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine

C10H26N4 — CID 156769993

IUPAC3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine
SMILESCN(C)CCC(CCN)NCCCN
InChIInChI=1S/C10H26N4/c1-14(2)9-5-10(4-7-12)13-8-3-6-11/h10,13H,3-9,11-12H2,1-2H3
InChIKeyIPUPSCONAGDOQF-UHFFFAOYSA-N
MW202.35 g/mol
LogP-0.41
Rot. Bonds9

About 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine

3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine (PubChem CID 156769993) has the molecular formula C10H26N4 and a molecular weight of 202.35 g/mol. Its IUPAC name is 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine.

Molecular Properties

Compound Name3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine
PubChem CID156769993
Molecular FormulaC10H26N4
Molecular Weight202.35 g/mol
Exact Mass202.22
IUPAC Name3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine
SMILESCN(C)CCC(CCN)NCCCN
InChIInChI=1S/C10H26N4/c1-14(2)9-5-10(4-7-12)13-8-3-6-11/h10,13H,3-9,11-12H2,1-2H3
InChIKeyIPUPSCONAGDOQF-UHFFFAOYSA-N
XLogP-0.41
TPSA67.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.35
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-N'-[3-(dimethylamino)propyl]-3-N,3-N-dimethylpropane-1,1,3-triamine
CID 57022854
1-N-[3-(dimethylamino)propyl]-1-N',1-N'-diethylpropane-1,1,3-triamine
CID 57019902
3-N-propylhexane-1,3-diamine
CID 88724695
1-N,1-N-bis[2-(dimethylamino)ethyl]-3-N-methylhexane-1,3,6-triamine
CID 140879902
2-N-dodecylbutane-1,2,4-triamine
CID 19990016
1-N,1-N,4-N,4-N-tetramethyl-2-N-[2-(methylamino)ethyl]butane-1,2,4-triamine
CID 130303694
3-N-ethyl-1-N,1-N-dimethyloctane-1,3-diamine
CID 115346552
N-(3-aminopropyl)-N',N'-dimethylhexane-1,6-diamine
CID 23461237
1-N,1-N-dimethyl-3-N-propylhept-6-ene-1,3-diamine
CID 115346716
N',N'-dimethyl-N-pentan-3-ylheptane-1,7-diamine
CID 115712735
3-[3-(dimethylamino)propylamino]dodecan-1-ol
CID 169107448
bis(N',N'-dimethylpropane-1,3-diamine);dihydrochloride
CID 173033128

Frequently Asked Questions

What is the IUPAC name of 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine?
The IUPAC name of 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine (CID 156769993) is 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine.
What is the SMILES notation for 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine?
The canonical SMILES for 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine is CN(C)CCC(CCN)NCCCN.
What is the InChIKey of 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine?
The InChIKey is IPUPSCONAGDOQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H26N4/c1-14(2)9-5-10(4-7-12)13-8-3-6-11/h10,13H,3-9,11-12H2,1-2H3.
What are the key properties of 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine?
3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine has a molecular weight of 202.35 g/mol, XLogP of -0.41, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-aminopropyl)-5-N,5-N-dimethylpentane-1,3,5-triamine is sourced from PubChem (CID 156769993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).