1-(2-methylidenebutyl)piperidin-3-amine

C10H20N2 — CID 66047170

IUPAC1-(2-methylidenebutyl)piperidin-3-amine
SMILESC=C(CC)CN1CCCC(N)C1
InChIInChI=1S/C10H20N2/c1-3-9(2)7-12-6-4-5-10(11)8-12/h10H,2-8,11H2,1H3
InChIKeyLTDOATSBTXUCIH-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.38
Rot. Bonds3

About 1-(2-methylidenebutyl)piperidin-3-amine

1-(2-methylidenebutyl)piperidin-3-amine (PubChem CID 66047170) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(2-methylidenebutyl)piperidin-3-amine.

Molecular Properties

Compound Name1-(2-methylidenebutyl)piperidin-3-amine
PubChem CID66047170
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-(2-methylidenebutyl)piperidin-3-amine
SMILESC=C(CC)CN1CCCC(N)C1
InChIInChI=1S/C10H20N2/c1-3-9(2)7-12-6-4-5-10(11)8-12/h10H,2-8,11H2,1H3
InChIKeyLTDOATSBTXUCIH-UHFFFAOYSA-N
XLogP1.38
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[1-(2-methylidenebutyl)piperidin-3-yl]methyl]propan-2-amine
CID 66043827
1-(2-methylidenebutyl)-3-pyrrolidin-2-ylpiperidine
CID 66046701
(2R)-1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol
CID 106933676
1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol
CID 102984754
(3R)-1-(3-chloro-2-methylprop-2-enyl)piperidin-3-amine
CID 106439538
2-methyl-2-[1-(2-methylidenebutyl)piperidin-3-yl]propanoic acid
CID 83198145
N-methyl-1-(2-methylidenebutyl)pyrrolidin-3-amine
CID 115300685
(2R)-1-[(3R)-3-aminopiperidin-1-yl]propan-2-ol;hydrochloride
CID 170983124
4-(3-aminopiperidin-1-yl)-3-methylbut-2-enoic acid
CID 77006059
2-(3-aminopiperidin-1-yl)ethanol
CID 61296854
ethyl 5-(3-aminopiperidin-1-yl)-4-oxopentanoate
CID 103484354
1-(3-methyl-2-propan-2-ylbutyl)piperidin-3-amine
CID 102908367

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylidenebutyl)piperidin-3-amine?
The IUPAC name of 1-(2-methylidenebutyl)piperidin-3-amine (CID 66047170) is 1-(2-methylidenebutyl)piperidin-3-amine.
What is the SMILES notation for 1-(2-methylidenebutyl)piperidin-3-amine?
The canonical SMILES for 1-(2-methylidenebutyl)piperidin-3-amine is C=C(CC)CN1CCCC(N)C1.
What is the InChIKey of 1-(2-methylidenebutyl)piperidin-3-amine?
The InChIKey is LTDOATSBTXUCIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-9(2)7-12-6-4-5-10(11)8-12/h10H,2-8,11H2,1H3.
What are the key properties of 1-(2-methylidenebutyl)piperidin-3-amine?
1-(2-methylidenebutyl)piperidin-3-amine has a molecular weight of 168.28 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylidenebutyl)piperidin-3-amine is sourced from PubChem (CID 66047170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).