N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine

C17H32N4 — CID 102994077

IUPACN'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine
SMILESCCNC(CC)c1ccc(N(CC)CCCN(C)C)cn1
InChIInChI=1S/C17H32N4/c1-6-16(18-7-2)17-11-10-15(14-19-17)21(8-3)13-9-12-20(4)5/h10-11,14,16,18H,6-9,12-13H2,1-5H3
InChIKeyYBMAPYCVJPMDEM-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.92
Rot. Bonds10

About N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine

N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine (PubChem CID 102994077) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine
PubChem CID102994077
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC NameN'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine
SMILESCCNC(CC)c1ccc(N(CC)CCCN(C)C)cn1
InChIInChI=1S/C17H32N4/c1-6-16(18-7-2)17-11-10-15(14-19-17)21(8-3)13-9-12-20(4)5/h10-11,14,16,18H,6-9,12-13H2,1-5H3
InChIKeyYBMAPYCVJPMDEM-UHFFFAOYSA-N
XLogP2.92
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[1-(ethylamino)propyl]-N,N-dimethylpyridin-3-amine
CID 112584103
N-ethyl-6-[1-(ethylamino)propyl]-N-prop-2-ynylpyridin-3-amine
CID 112584544
6-[1-(ethylamino)propyl]-N-prop-2-enyl-N-propylpyridin-3-amine
CID 112584559
6-[1-(ethylamino)propyl]-N-methyl-N-(3-methylbutyl)pyridin-3-amine
CID 112584276
N,N-dipropyl-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939175
2-[2,2-difluoroethyl-[6-[1-(ethylamino)propyl]-3-pyridinyl]amino]ethanol
CID 107480571
2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-methylamino]propan-1-ol
CID 104552388
N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
CID 115939191
3-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]propan-1-ol
CID 115939424
6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine
CID 115939736
2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol
CID 112584333
N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
CID 112584247

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine?
The IUPAC name of N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine (CID 102994077) is N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine.
What is the SMILES notation for N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine?
The canonical SMILES for N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine is CCNC(CC)c1ccc(N(CC)CCCN(C)C)cn1.
What is the InChIKey of N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine?
The InChIKey is YBMAPYCVJPMDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-6-16(18-7-2)17-11-10-15(14-19-17)21(8-3)13-9-12-20(4)5/h10-11,14,16,18H,6-9,12-13H2,1-5H3.
What are the key properties of N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine?
N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine has a molecular weight of 292.47 g/mol, XLogP of 2.92, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine is sourced from PubChem (CID 102994077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).