N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine

C13H30N2 — CID 166733537

IUPACN-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine
SMILESCCCN(CCC)CCN(C)CC(C)C
InChIInChI=1S/C13H30N2/c1-6-8-15(9-7-2)11-10-14(5)12-13(3)4/h13H,6-12H2,1-5H3
InChIKeySRRKMDORDJMDGB-UHFFFAOYSA-N
MW214.40 g/mol
LogP2.70
Rot. Bonds9

About N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine

N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine (PubChem CID 166733537) has the molecular formula C13H30N2 and a molecular weight of 214.40 g/mol. Its IUPAC name is N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine.

Molecular Properties

Compound NameN-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine
PubChem CID166733537
Molecular FormulaC13H30N2
Molecular Weight214.40 g/mol
Exact Mass214.24
IUPAC NameN-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine
SMILESCCCN(CCC)CCN(C)CC(C)C
InChIInChI=1S/C13H30N2/c1-6-8-15(9-7-2)11-10-14(5)12-13(3)4/h13H,6-12H2,1-5H3
InChIKeySRRKMDORDJMDGB-UHFFFAOYSA-N
XLogP2.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.40
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N'-(2-methylpropyl)-N,N'-dipropylethane-1,2-diamine
CID 123205995
1-[2-(dipropylamino)ethyl-(2-hydroxypropyl)amino]propan-2-ol
CID 19890051
1-[2-methylpropyl(propyl)amino]propan-2-ol
CID 145414853
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
N,3-dimethyl-N-propylbutan-1-amine;ethane
CID 143004983
[2-methylpropyl(propyl)amino]methanol
CID 54162178
3,3-dimethylpentane;N,N-dipropylpropan-1-amine;2-methyl-N,N-bis(2-methylpropyl)propan-1-amine
CID 54182914
7-methyl-N,N-dipropyloctan-1-amine
CID 140640733
15-methyl-N,N-dipropylhexadecan-1-amine
CID 139724040
N,N,N',N'-tetrakis(2-methylpropyl)ethane-1,2-diamine
CID 18709992
copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dibromide
CID 173220545
copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dichloride
CID 173220390

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine?
The IUPAC name of N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine (CID 166733537) is N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine.
What is the SMILES notation for N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine?
The canonical SMILES for N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine is CCCN(CCC)CCN(C)CC(C)C.
What is the InChIKey of N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine?
The InChIKey is SRRKMDORDJMDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2/c1-6-8-15(9-7-2)11-10-14(5)12-13(3)4/h13H,6-12H2,1-5H3.
What are the key properties of N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine?
N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine has a molecular weight of 214.40 g/mol, XLogP of 2.70, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylpropyl)-N',N'-dipropylethane-1,2-diamine is sourced from PubChem (CID 166733537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).