(1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine

C12H24N2 — CID 83847751

IUPAC(1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine
SMILESCC(C)C1C(CN)CCCN1C1CC1
InChIInChI=1S/C12H24N2/c1-9(2)12-10(8-13)4-3-7-14(12)11-5-6-11/h9-12H,3-8,13H2,1-2H3
InChIKeyNGGSPBJMGKVRCA-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.84
Rot. Bonds3

About (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine

(1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine (PubChem CID 83847751) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine.

Molecular Properties

Compound Name(1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine
PubChem CID83847751
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name(1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine
SMILESCC(C)C1C(CN)CCCN1C1CC1
InChIInChI=1S/C12H24N2/c1-9(2)12-10(8-13)4-3-7-14(12)11-5-6-11/h9-12H,3-8,13H2,1-2H3
InChIKeyNGGSPBJMGKVRCA-UHFFFAOYSA-N
XLogP1.84
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine?
The IUPAC name of (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine (CID 83847751) is (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine.
What is the SMILES notation for (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine?
The canonical SMILES for (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine is CC(C)C1C(CN)CCCN1C1CC1.
What is the InChIKey of (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine?
The InChIKey is NGGSPBJMGKVRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9(2)12-10(8-13)4-3-7-14(12)11-5-6-11/h9-12H,3-8,13H2,1-2H3.
What are the key properties of (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine?
(1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine has a molecular weight of 196.34 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopropyl-2-propan-2-ylpiperidin-3-yl)methanamine is sourced from PubChem (CID 83847751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).