N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine

C17H36N2 — CID 106624638

IUPACN-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine
SMILESCCCCCCCC(C)N(CC)CC1CCCNC1
InChIInChI=1S/C17H36N2/c1-4-6-7-8-9-11-16(3)19(5-2)15-17-12-10-13-18-14-17/h16-18H,4-15H2,1-3H3
InChIKeyXBILMMZBSRLYDG-UHFFFAOYSA-N
MW268.49 g/mol
LogP4.06
Rot. Bonds10

About N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine

N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine (PubChem CID 106624638) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine.

Molecular Properties

Compound NameN-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine
PubChem CID106624638
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC NameN-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine
SMILESCCCCCCCC(C)N(CC)CC1CCCNC1
InChIInChI=1S/C17H36N2/c1-4-6-7-8-9-11-16(3)19(5-2)15-17-12-10-13-18-14-17/h16-18H,4-15H2,1-3H3
InChIKeyXBILMMZBSRLYDG-UHFFFAOYSA-N
XLogP4.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-N-(piperidin-3-ylmethyl)heptan-4-amine
CID 106624422
N-ethyl-N-(pyrrolidin-2-ylmethyl)nonan-2-amine
CID 106603643
N-ethyl-4-phenyl-N-(piperidin-3-ylmethyl)butan-2-amine
CID 106624545
N-ethyl-N-(pyrrolidin-2-ylmethyl)heptan-2-amine
CID 106603679
N-methyl-N-(piperidin-3-ylmethyl)octan-1-amine
CID 106623723
N-(piperidin-4-ylmethyl)-N-propylnonan-2-amine
CID 79715186
(3S)-3-heptylpiperidine
CID 155456188
N-hexyl-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106624769
3-[ethyl(piperidin-3-ylmethyl)amino]pentanenitrile
CID 106638814
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
(3R)-3-(2-methylhexyl)piperidine
CID 155456169
2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide
CID 106628997

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine?
The IUPAC name of N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine (CID 106624638) is N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine.
What is the SMILES notation for N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine?
The canonical SMILES for N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine is CCCCCCCC(C)N(CC)CC1CCCNC1.
What is the InChIKey of N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine?
The InChIKey is XBILMMZBSRLYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2/c1-4-6-7-8-9-11-16(3)19(5-2)15-17-12-10-13-18-14-17/h16-18H,4-15H2,1-3H3.
What are the key properties of N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine?
N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine has a molecular weight of 268.49 g/mol, XLogP of 4.06, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine is sourced from PubChem (CID 106624638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).