N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide

C14H27N3O2 — CID 54871679

IUPACN-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)CCCNC)CC1
InChIInChI=1S/C14H27N3O2/c1-3-5-13(18)16-12-7-10-17(11-8-12)14(19)6-4-9-15-2/h12,15H,3-11H2,1-2H3,(H,16,18)
InChIKeyFBWLDMYPRFOEDO-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.89
Rot. Bonds7

About N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide

N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide (PubChem CID 54871679) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide.

Molecular Properties

Compound NameN-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide
PubChem CID54871679
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)CCCNC)CC1
InChIInChI=1S/C14H27N3O2/c1-3-5-13(18)16-12-7-10-17(11-8-12)14(19)6-4-9-15-2/h12,15H,3-11H2,1-2H3,(H,16,18)
InChIKeyFBWLDMYPRFOEDO-UHFFFAOYSA-N
XLogP0.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-[2-(methylamino)acetyl]piperidin-4-yl]butanamide
CID 54871655
N-[1-[3-(ethylamino)propanoyl]piperidin-4-yl]butanamide
CID 62835122
4-(methylamino)-1-(4-methylpiperidin-1-yl)butan-1-one
CID 60649292
4-(methylamino)-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;hydrochloride
CID 119806019
N-[1-[4-(propan-2-ylamino)butanoyl]piperidin-4-yl]propanamide
CID 60947455
N-[1-[2-(cyclopropylmethylamino)acetyl]piperidin-4-yl]butanamide
CID 60948008
1-[4-(methylamino)piperidin-1-yl]hexan-1-one
CID 60818219
N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]butanamide
CID 110821940
1-[1-[4-(methylamino)butanoyl]piperidin-4-yl]-3-phenylurea;hydrochloride
CID 119750416
ethyl N-(1-butanoylpiperidin-4-yl)carbamate
CID 110819279
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-4-(methylamino)butan-1-one
CID 54874514
N-[1-[3-(propan-2-ylamino)propanoyl]piperidin-4-yl]propanamide
CID 54872195

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide?
The IUPAC name of N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide (CID 54871679) is N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide.
What is the SMILES notation for N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide?
The canonical SMILES for N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide is CCCC(=O)NC1CCN(C(=O)CCCNC)CC1.
What is the InChIKey of N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide?
The InChIKey is FBWLDMYPRFOEDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-3-5-13(18)16-12-7-10-17(11-8-12)14(19)6-4-9-15-2/h12,15H,3-11H2,1-2H3,(H,16,18).
What are the key properties of N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide?
N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide has a molecular weight of 269.39 g/mol, XLogP of 0.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide is sourced from PubChem (CID 54871679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).