1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine

C13H28N2 — CID 102908367

IUPAC1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine
SMILESCC(C)C(CN1CCCC(N)C1)C(C)C
InChIInChI=1S/C13H28N2/c1-10(2)13(11(3)4)9-15-7-5-6-12(14)8-15/h10-13H,5-9,14H2,1-4H3
InChIKeyFXVFTKKWRFNFHF-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.34
Rot. Bonds4

About 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine

1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine (PubChem CID 102908367) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine.

Molecular Properties

Compound Name1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine
PubChem CID102908367
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine
SMILESCC(C)C(CN1CCCC(N)C1)C(C)C
InChIInChI=1S/C13H28N2/c1-10(2)13(11(3)4)9-15-7-5-6-12(14)8-15/h10-13H,5-9,14H2,1-4H3
InChIKeyFXVFTKKWRFNFHF-UHFFFAOYSA-N
XLogP2.34
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol
CID 102984754
(2R)-1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol
CID 106933676
(2R)-1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol;hydrochloride
CID 170983124
3-methyl-1-(3-methyl-2-propan-2-ylbutyl)piperidin-4-amine
CID 102906329
N-[[1-(3-methyl-2-propan-2-ylbutyl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 102906427
(2S)-1-(3-aminopyrrolidin-1-yl)propan-2-ol
CID 103840761
2-(3-aminopiperidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 61297413
2-[(3R)-3-aminopiperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 102977545
(3S)-1-(3-propan-2-yloxypropyl)piperidin-3-amine
CID 39221513
1-(2-methylbutyl)azocan-5-amine
CID 138578354
N-methyl-1-[1-(3-methyl-2-propan-2-ylbutyl)pyrrolidin-3-yl]methanamine
CID 102906426
1-(2-methylidenebutyl)piperidin-3-amine
CID 66047170

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine?
The IUPAC name of 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine (CID 102908367) is 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine.
What is the SMILES notation for 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine?
The canonical SMILES for 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine is CC(C)C(CN1CCCC(N)C1)C(C)C.
What is the InChIKey of 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine?
The InChIKey is FXVFTKKWRFNFHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-10(2)13(11(3)4)9-15-7-5-6-12(14)8-15/h10-13H,5-9,14H2,1-4H3.
What are the key properties of 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine?
1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine is sourced from PubChem (CID 102908367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).