N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine

C13H28N2 — CID 64705920

IUPACN-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine
SMILESCCNC(C)CC(C)N1CCCC(C)C1
InChIInChI=1S/C13H28N2/c1-5-14-12(3)9-13(4)15-8-6-7-11(2)10-15/h11-14H,5-10H2,1-4H3
InChIKeyONINXXCYUWJWFJ-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.49
Rot. Bonds5

About N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine

N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine (PubChem CID 64705920) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine
PubChem CID64705920
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine
SMILESCCNC(C)CC(C)N1CCCC(C)C1
InChIInChI=1S/C13H28N2/c1-5-14-12(3)9-13(4)15-8-6-7-11(2)10-15/h11-14H,5-10H2,1-4H3
InChIKeyONINXXCYUWJWFJ-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,3-dimethylpiperidin-1-yl)-N-ethylpentan-2-amine
CID 64707637
2-methyl-N-[2-(3-methylpiperidin-1-yl)propyl]butan-1-amine
CID 115887280
4-(3,3-dimethylpiperidin-1-yl)-N-ethylpentan-2-amine
CID 64708691
N-tert-butyl-3-(3-methylpiperidin-1-yl)butan-1-amine
CID 62437982
N-ethyl-4-morpholin-4-ylpentan-2-amine
CID 64706123
N-[4-(3-methylpiperidin-1-yl)pentyl]cyclopropanamine
CID 62437779
2,2-dimethyl-N-[2-(3-methylpiperidin-1-yl)propyl]propan-1-amine
CID 115607178
1-ethyl-2-[2-(3-methylpiperidin-1-yl)propyl]-3-prop-2-ynylguanidine
CID 111849107
N-[(2S)-2-[(3S)-3-methylpiperidin-1-yl]propyl]piperidine-1-sulfonamide
CID 94061348
N,N-diethyl-1-(3-methylpiperidin-1-yl)ethanamine
CID 168861294
N-[(2R)-2-(ethylamino)propyl]-3-methylpiperidine-1-sulfonamide;hydrochloride
CID 120664457
1-ethyl-3-(1-methoxypropan-2-yl)-2-[2-(3-methylpiperidin-1-yl)propyl]guanidine
CID 111234307

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine?
The IUPAC name of N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine (CID 64705920) is N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine.
What is the SMILES notation for N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine?
The canonical SMILES for N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine is CCNC(C)CC(C)N1CCCC(C)C1.
What is the InChIKey of N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine?
The InChIKey is ONINXXCYUWJWFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-14-12(3)9-13(4)15-8-6-7-11(2)10-15/h11-14H,5-10H2,1-4H3.
What are the key properties of N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine?
N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine has a molecular weight of 212.38 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(3-methylpiperidin-1-yl)pentan-2-amine is sourced from PubChem (CID 64705920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).