4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide

C14H29N3O — CID 103494590

IUPAC4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide
SMILESCC(C)C1CCN(C(CN)CC(=O)N(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-11(2)12-5-7-17(8-6-12)13(10-15)9-14(18)16(3)4/h11-13H,5-10,15H2,1-4H3
InChIKeyOQJWFJZGQGPAKL-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.16
Rot. Bonds5

About 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide

4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide (PubChem CID 103494590) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide.

Molecular Properties

Compound Name4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide
PubChem CID103494590
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide
SMILESCC(C)C1CCN(C(CN)CC(=O)N(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-11(2)12-5-7-17(8-6-12)13(10-15)9-14(18)16(3)4/h11-13H,5-10,15H2,1-4H3
InChIKeyOQJWFJZGQGPAKL-UHFFFAOYSA-N
XLogP1.16
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide?
The IUPAC name of 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide (CID 103494590) is 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide.
What is the SMILES notation for 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide?
The canonical SMILES for 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide is CC(C)C1CCN(C(CN)CC(=O)N(C)C)CC1.
What is the InChIKey of 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide?
The InChIKey is OQJWFJZGQGPAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)12-5-7-17(8-6-12)13(10-15)9-14(18)16(3)4/h11-13H,5-10,15H2,1-4H3.
What are the key properties of 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide?
4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide has a molecular weight of 255.41 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide is sourced from PubChem (CID 103494590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).