N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine

C16H28N4 — CID 43761755

IUPACN',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CCN(c2ccccn2)CC1
InChIInChI=1S/C16H28N4/c1-3-19(4-2)14-11-17-15-8-12-20(13-9-15)16-7-5-6-10-18-16/h5-7,10,15,17H,3-4,8-9,11-14H2,1-2H3
InChIKeyFKYVNIJFMKPSBM-UHFFFAOYSA-N
MW276.43 g/mol
LogP1.98
Rot. Bonds7

About N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine

N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine (PubChem CID 43761755) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine
PubChem CID43761755
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC NameN',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CCN(c2ccccn2)CC1
InChIInChI=1S/C16H28N4/c1-3-19(4-2)14-11-17-15-8-12-20(13-9-15)16-7-5-6-10-18-16/h5-7,10,15,17H,3-4,8-9,11-14H2,1-2H3
InChIKeyFKYVNIJFMKPSBM-UHFFFAOYSA-N
XLogP1.98
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylsulfanylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 63983974
N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675384
1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 43761318
N-(3-methylsulfanylpropyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675357
N-[2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethyl]cyclopropanecarboxamide
CID 115706396
N-(5-methylhexyl)-1-pyridin-2-ylpiperidin-4-amine
CID 81338605
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 119126767
N-(3-methoxy-3-methylbutyl)-1-pyridin-2-ylpiperidin-4-amine
CID 106675135
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-1-pyridin-2-ylpiperidin-4-amine
CID 63332224
2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethylurea
CID 83111405
N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 79002061
(3R)-N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 141191344

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine (CID 43761755) is N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine is CCN(CC)CCNC1CCN(c2ccccn2)CC1.
What is the InChIKey of N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine?
The InChIKey is FKYVNIJFMKPSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-3-19(4-2)14-11-17-15-8-12-20(13-9-15)16-7-5-6-10-18-16/h5-7,10,15,17H,3-4,8-9,11-14H2,1-2H3.
What are the key properties of N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine?
N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine has a molecular weight of 276.43 g/mol, XLogP of 1.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 43761755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).