N',N',2-tripropylpropane-1,3-diamine

C12H28N2 — CID 65228607

IUPACN',N',2-tripropylpropane-1,3-diamine
SMILESCCCC(CN)CN(CCC)CCC
InChIInChI=1S/C12H28N2/c1-4-7-12(10-13)11-14(8-5-2)9-6-3/h12H,4-11,13H2,1-3H3
InChIKeyRGMPARXDMOHSMN-UHFFFAOYSA-N
MW200.37 g/mol
LogP2.48
Rot. Bonds9

About N',N',2-tripropylpropane-1,3-diamine

N',N',2-tripropylpropane-1,3-diamine (PubChem CID 65228607) has the molecular formula C12H28N2 and a molecular weight of 200.37 g/mol. Its IUPAC name is N',N',2-tripropylpropane-1,3-diamine.

Molecular Properties

Compound NameN',N',2-tripropylpropane-1,3-diamine
PubChem CID65228607
Molecular FormulaC12H28N2
Molecular Weight200.37 g/mol
Exact Mass200.23
IUPAC NameN',N',2-tripropylpropane-1,3-diamine
SMILESCCCC(CN)CN(CCC)CCC
InChIInChI=1S/C12H28N2/c1-4-7-12(10-13)11-14(8-5-2)9-6-3/h12H,4-11,13H2,1-3H3
InChIKeyRGMPARXDMOHSMN-UHFFFAOYSA-N
XLogP2.48
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,1-N-dipropylpentane-1,2-diamine
CID 43650406
ethane;2-ethyl-N,N-dipropylbutan-1-amine
CID 145001247
N'-[2-(bromomethyl)pentyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 65010680
N'-ethyl-2-propyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 65233130
N'-(cyclopropylmethyl)-N'-ethyl-2-propylpropane-1,3-diamine
CID 65233033
N'-(2,2-dimethylpropyl)-N'-methyl-2-propylpropane-1,3-diamine
CID 65233192
2-[(dipropylamino)methyl]pentanamide
CID 23363408
(2S)-1-N,1-N-bis(2-aminoethyl)pentane-1,2-diamine
CID 129302821
N'-(2-aminoethyl)-N'-(2-methylpentyl)ethane-1,2-diamine
CID 62923464
2-propylheptan-1-amine
CID 21267775
(3S)-3-(aminomethyl)hexan-1-ol
CID 95566845
N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
CID 65233301

Frequently Asked Questions

What is the IUPAC name of N',N',2-tripropylpropane-1,3-diamine?
The IUPAC name of N',N',2-tripropylpropane-1,3-diamine (CID 65228607) is N',N',2-tripropylpropane-1,3-diamine.
What is the SMILES notation for N',N',2-tripropylpropane-1,3-diamine?
The canonical SMILES for N',N',2-tripropylpropane-1,3-diamine is CCCC(CN)CN(CCC)CCC.
What is the InChIKey of N',N',2-tripropylpropane-1,3-diamine?
The InChIKey is RGMPARXDMOHSMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2/c1-4-7-12(10-13)11-14(8-5-2)9-6-3/h12H,4-11,13H2,1-3H3.
What are the key properties of N',N',2-tripropylpropane-1,3-diamine?
N',N',2-tripropylpropane-1,3-diamine has a molecular weight of 200.37 g/mol, XLogP of 2.48, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N',2-tripropylpropane-1,3-diamine is sourced from PubChem (CID 65228607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).