2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine

C17H32N4 — CID 103191525

IUPAC2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine
SMILESCCN(c1cc(CNC)cc(C(C)C)n1)C(C)CN(C)C
InChIInChI=1S/C17H32N4/c1-8-21(14(4)12-20(6)7)17-10-15(11-18-5)9-16(19-17)13(2)3/h9-10,13-14,18H,8,11-12H2,1-7H3
InChIKeyUJOMVXCHQOJOGV-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.70
Rot. Bonds8

About 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine

2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine (PubChem CID 103191525) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine
PubChem CID103191525
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC Name2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine
SMILESCCN(c1cc(CNC)cc(C(C)C)n1)C(C)CN(C)C
InChIInChI=1S/C17H32N4/c1-8-21(14(4)12-20(6)7)17-10-15(11-18-5)9-16(19-17)13(2)3/h9-10,13-14,18H,8,11-12H2,1-7H3
InChIKeyUJOMVXCHQOJOGV-UHFFFAOYSA-N
XLogP2.70
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-ethyl-1-N,1-N-dimethyl-2-N-[6-(methylaminomethyl)pyrazin-2-yl]propane-1,2-diamine
CID 103191522
4-N-[1-(dimethylamino)propan-2-yl]-4-N-ethyl-2-N-methyl-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 103192516
4-ethyl-N,N-dimethyl-6-propan-2-ylpyridin-2-amine
CID 165411396
6-ethyl-N-methyl-4-(methylaminomethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 113381344
6-ethyl-N-methyl-4-(methylaminomethyl)-N-(3-methylbutyl)pyridin-2-amine
CID 113381387
N,6-dimethyl-4-(methylaminomethyl)-N-(2-methylbutyl)pyridin-2-amine
CID 113379327
4-N-[1-(dimethylamino)propan-2-yl]-4-N-ethyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106773395
2-N-ethyl-1-N,1-N-dimethyl-2-N-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]propane-1,2-diamine
CID 103189987
2-N-ethyl-1-N,1-N-dimethyl-2-N-[3-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]propane-1,2-diamine
CID 103190021
1-[2-[1-(dimethylamino)propan-2-yl-ethylamino]-1,3-thiazol-4-yl]ethanol
CID 103191902
2-N-[6-[(cyclopropylamino)methyl]-2-pyridinyl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191474
2-N-[6-[(cyclopropylamino)methyl]pyrazin-2-yl]-2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191593

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine?
The IUPAC name of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine (CID 103191525) is 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine is CCN(c1cc(CNC)cc(C(C)C)n1)C(C)CN(C)C.
What is the InChIKey of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine?
The InChIKey is UJOMVXCHQOJOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-8-21(14(4)12-20(6)7)17-10-15(11-18-5)9-16(19-17)13(2)3/h9-10,13-14,18H,8,11-12H2,1-7H3.
What are the key properties of 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine?
2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine has a molecular weight of 292.47 g/mol, XLogP of 2.70, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-1-N,1-N-dimethyl-2-N-[4-(methylaminomethyl)-6-propan-2-yl-2-pyridinyl]propane-1,2-diamine is sourced from PubChem (CID 103191525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).