N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide

C16H29N3O2 — CID 63876316

IUPACN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1CCN(C2CC2)C1
InChIInChI=1S/C16H29N3O2/c20-16(6-10-21-15-3-7-17-8-4-15)18-11-13-5-9-19(12-13)14-1-2-14/h13-15,17H,1-12H2,(H,18,20)
InChIKeyBVMFOZRYHKPGFH-UHFFFAOYSA-N
MW295.43 g/mol
LogP0.75
Rot. Bonds7

About N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide

N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide (PubChem CID 63876316) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide
PubChem CID63876316
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC NameN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1CCN(C2CC2)C1
InChIInChI=1S/C16H29N3O2/c20-16(6-10-21-15-3-7-17-8-4-15)18-11-13-5-9-19(12-13)14-1-2-14/h13-15,17H,1-12H2,(H,18,20)
InChIKeyBVMFOZRYHKPGFH-UHFFFAOYSA-N
XLogP0.75
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-hydroxycyclobutyl)methyl]-3-piperidin-4-yloxypropanamide
CID 66007009
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-3-methoxypropanamide
CID 125446366
N-[(3-hydroxycyclopentyl)methyl]-3-piperidin-4-yloxypropanamide
CID 106133903
6-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-6-oxohexanoic acid
CID 60856961
5-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-5-oxopentanoic acid
CID 54927021
N-[(1-cyclohexylpyrrolidin-3-yl)methyl]-3-ethoxypropanamide
CID 122559584
3-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-3-oxopropanoic acid
CID 62231885
2-chloro-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]acetamide
CID 60809819
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-(methylamino)butanamide
CID 60859292
N-[(1-piperidin-4-ylpiperidin-4-yl)methyl]acetamide
CID 102736375
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-oxobutanamide
CID 60975912
N-[(1,1-dioxothiolan-2-yl)methyl]-3-piperidin-4-yloxypropanamide
CID 81039234

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide (CID 63876316) is N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide is O=C(CCOC1CCNCC1)NCC1CCN(C2CC2)C1.
What is the InChIKey of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
The InChIKey is BVMFOZRYHKPGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2/c20-16(6-10-21-15-3-7-17-8-4-15)18-11-13-5-9-19(12-13)14-1-2-14/h13-15,17H,1-12H2,(H,18,20).
What are the key properties of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide has a molecular weight of 295.43 g/mol, XLogP of 0.75, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 63876316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).