N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine

C14H29N3 — CID 65070247

IUPACN-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine
SMILESCCN1CCCC(NC2CCCN(C)CC2)C1
InChIInChI=1S/C14H29N3/c1-3-17-10-5-7-14(12-17)15-13-6-4-9-16(2)11-8-13/h13-15H,3-12H2,1-2H3
InChIKeyZTAWNFHNNBOYTC-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.54
Rot. Bonds3

About N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine

N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine (PubChem CID 65070247) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine.

Molecular Properties

Compound NameN-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine
PubChem CID65070247
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine
SMILESCCN1CCCC(NC2CCCN(C)CC2)C1
InChIInChI=1S/C14H29N3/c1-3-17-10-5-7-14(12-17)15-13-6-4-9-16(2)11-8-13/h13-15H,3-12H2,1-2H3
InChIKeyZTAWNFHNNBOYTC-UHFFFAOYSA-N
XLogP1.54
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-1-methylazepan-4-amine
CID 65071330
N-(1-cyclopropylpyrrolidin-3-yl)-1-ethylpiperidin-3-amine
CID 62982857
N-cyclopropyl-1-[2-(1-methylpiperidin-4-yl)ethyl]piperidin-3-amine
CID 114516764
1-ethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidin-3-amine
CID 63452666
N-(1-benzylpyrrolidin-3-yl)-1-methylazepan-4-amine
CID 65070074
N-cyclopentyl-1-methylpiperidin-4-amine;dihydrochloride
CID 53408550
N-(1-ethylpyrrolidin-3-yl)piperidin-3-amine
CID 130948313
N-(1,1-dioxothian-4-yl)-1-ethylazepan-4-amine
CID 65074346
N-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]piperidin-3-amine
CID 114401290
1-ethyl-N-(5-methylthiolan-3-yl)piperidin-3-amine
CID 79950427
N-cyclopropyl-1-methylpyrrolidin-3-amine;ethane;N-methylpropan-1-amine;1-methylpyrrolidine
CID 167502882
1-ethyl-N-(2-methylthiolan-3-yl)piperidin-3-amine
CID 102671684

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine?
The IUPAC name of N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine (CID 65070247) is N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine.
What is the SMILES notation for N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine?
The canonical SMILES for N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine is CCN1CCCC(NC2CCCN(C)CC2)C1.
What is the InChIKey of N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine?
The InChIKey is ZTAWNFHNNBOYTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-3-17-10-5-7-14(12-17)15-13-6-4-9-16(2)11-8-13/h13-15H,3-12H2,1-2H3.
What are the key properties of N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine?
N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine has a molecular weight of 239.41 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-3-yl)-1-methylazepan-4-amine is sourced from PubChem (CID 65070247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).