(2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine

C10H22N2 — CID 103934495

IUPAC(2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine
SMILESCCC1CCCN(C[C@H](C)N)C1
InChIInChI=1S/C10H22N2/c1-3-10-5-4-6-12(8-10)7-9(2)11/h9-10H,3-8,11H2,1-2H3/t9-,10?/m0/s1
InChIKeyITDROMILIVNVFI-RGURZIINSA-N
MW170.30 g/mol
LogP1.46
Rot. Bonds3

About (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine

(2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine (PubChem CID 103934495) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine.

Molecular Properties

Compound Name(2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine
PubChem CID103934495
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name(2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine
SMILESCCC1CCCN(C[C@H](C)N)C1
InChIInChI=1S/C10H22N2/c1-3-10-5-4-6-12(8-10)7-9(2)11/h9-10H,3-8,11H2,1-2H3/t9-,10?/m0/s1
InChIKeyITDROMILIVNVFI-RGURZIINSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-ethylpiperidin-1-yl)butan-2-amine
CID 43584476
1-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-2-amine
CID 83835140
1-(2,2-dimethoxyethyl)-3-ethylpiperidine
CID 66221675
4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
CID 66454924
3-(3-ethylpiperidin-1-yl)-N'-hydroxy-2-methylpropanimidamide
CID 43584570
(3S)-1-[(2S)-2-aminopropyl]piperidin-3-ol
CID 124547059
2-[(3R)-3-ethylpiperidin-1-yl]ethanamine
CID 93187820
(2R)-1-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)propan-2-amine
CID 103934627
(2R)-1-(3-methylsulfanylpiperidin-1-yl)propan-2-amine
CID 127004218
1-(3-ethylpiperidin-1-yl)-4,4-dimethylpentan-3-amine
CID 62624076
3-(3-ethylpiperidin-1-yl)-2-methyl-N-propylpropan-1-amine
CID 62434338
1-(cyclobutylmethyl)-3-ethylpiperidine
CID 143174975

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine?
The IUPAC name of (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine (CID 103934495) is (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine.
What is the SMILES notation for (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine?
The canonical SMILES for (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine is CCC1CCCN(C[C@H](C)N)C1.
What is the InChIKey of (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine?
The InChIKey is ITDROMILIVNVFI-RGURZIINSA-N. The full InChI is InChI=1S/C10H22N2/c1-3-10-5-4-6-12(8-10)7-9(2)11/h9-10H,3-8,11H2,1-2H3/t9-,10?/m0/s1.
What are the key properties of (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine?
(2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine has a molecular weight of 170.30 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(3-ethylpiperidin-1-yl)propan-2-amine is sourced from PubChem (CID 103934495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).