N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine

C14H31N3 — CID 2846519

IUPACN'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine
SMILESCCCN1CCC(N(CC)CCN(C)C)CC1
InChIInChI=1S/C14H31N3/c1-5-9-16-10-7-14(8-11-16)17(6-2)13-12-15(3)4/h14H,5-13H2,1-4H3
InChIKeyZVSKCAFIZRYDMJ-UHFFFAOYSA-N
MW241.42 g/mol
LogP1.74
Rot. Bonds7

About N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine

N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine (PubChem CID 2846519) has the molecular formula C14H31N3 and a molecular weight of 241.42 g/mol. Its IUPAC name is N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine
PubChem CID2846519
Molecular FormulaC14H31N3
Molecular Weight241.42 g/mol
Exact Mass241.25
IUPAC NameN'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine
SMILESCCCN1CCC(N(CC)CCN(C)C)CC1
InChIInChI=1S/C14H31N3/c1-5-9-16-10-7-14(8-11-16)17(6-2)13-12-15(3)4/h14H,5-13H2,1-4H3
InChIKeyZVSKCAFIZRYDMJ-UHFFFAOYSA-N
XLogP1.74
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(2-methylprop-2-enyl)-1-propylpiperidin-4-amine
CID 783901
2-[2-[cyclopropyl(ethyl)amino]ethyl]-1-ethyl-3-(1-propylpiperidin-4-yl)guanidine
CID 111019039
3-[ethyl-(1-propylpiperidin-4-yl)amino]-2-methylpropanoic acid
CID 65062044
1-propyl-4-[(1-propylpiperidin-4-yl)methyl]piperidine
CID 172611487
N,N-dimethyl-1-(1-propylazocan-5-yl)methanamine
CID 146215533
N'-ethyl-2,2-dimethyl-N'-(1-propylazepan-4-yl)propane-1,3-diamine
CID 79660581
N'-methyl-N'-(1-propylazepan-4-yl)ethane-1,2-diamine
CID 65077334
[4-(diethylamino)piperidin-1-yl]methanol
CID 89090725
1-[3-(dimethylamino)propyl]piperidin-4-ol
CID 82075263
N-ethyl-1-propan-2-yl-N-propylpiperidin-4-amine
CID 142371504
N,2,2-trimethyl-N-(1-propylpiperidin-4-yl)propanamide
CID 64590731
3-methoxy-N-methyl-N-[(1-propylpiperidin-4-yl)methyl]cyclobutan-1-amine
CID 156885185

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine (CID 2846519) is N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine is CCCN1CCC(N(CC)CCN(C)C)CC1.
What is the InChIKey of N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine?
The InChIKey is ZVSKCAFIZRYDMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3/c1-5-9-16-10-7-14(8-11-16)17(6-2)13-12-15(3)4/h14H,5-13H2,1-4H3.
What are the key properties of N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine?
N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine has a molecular weight of 241.42 g/mol, XLogP of 1.74, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N,N-dimethyl-N'-(1-propylpiperidin-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 2846519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).