(4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone

C14H25N3O — CID 63131559

IUPAC(4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone
SMILESCC1(C(=O)N2CCN(C3CC3)CC2)CCCNC1
InChIInChI=1S/C14H25N3O/c1-14(5-2-6-15-11-14)13(18)17-9-7-16(8-10-17)12-3-4-12/h12,15H,2-11H2,1H3
InChIKeyQQVFQRCKTPSABC-UHFFFAOYSA-N
MW251.37 g/mol
LogP0.68
Rot. Bonds2

About (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone

(4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone (PubChem CID 63131559) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone.

Molecular Properties

Compound Name(4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone
PubChem CID63131559
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name(4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone
SMILESCC1(C(=O)N2CCN(C3CC3)CC2)CCCNC1
InChIInChI=1S/C14H25N3O/c1-14(5-2-6-15-11-14)13(18)17-9-7-16(8-10-17)12-3-4-12/h12,15H,2-11H2,1H3
InChIKeyQQVFQRCKTPSABC-UHFFFAOYSA-N
XLogP0.68
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-cyclopentylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone
CID 63133084
(4-cyclopentylpiperazin-1-yl)-(3-methylpyrrolidin-3-yl)methanone;dihydrochloride
CID 119843049
(3-methylpiperidin-3-yl)-(4-methylpiperidin-1-yl)methanone
CID 63132368
(3-methylpiperidin-3-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
CID 63172091
(4-cyclopentylpiperazin-1-yl)-(3-ethylpiperidin-3-yl)methanone
CID 63133034
1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl-(3-methylpiperidin-3-yl)methanone
CID 119945501
1-[4-(3-methylpiperidine-3-carbonyl)-1,4-diazepan-1-yl]propan-1-one
CID 63131526
N-[1-(3-methylpiperidine-3-carbonyl)piperidin-4-yl]cyclopropanecarboxamide;hydrochloride
CID 119944157
azetidin-1-yl-(3-methylpyrrolidin-3-yl)methanone
CID 130547014
1-methyl-4-(3-methylpiperidine-3-carbonyl)piperazin-2-one
CID 64681617
(3-methylpyrrolidin-3-yl)-(3-pyrrolidin-1-ylpiperidin-1-yl)methanone;dihydrochloride
CID 119858272
N-[1-(3-methylpiperidine-3-carbonyl)piperidin-4-yl]butanamide
CID 63131758

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone?
The IUPAC name of (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone (CID 63131559) is (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone.
What is the SMILES notation for (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone?
The canonical SMILES for (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone is CC1(C(=O)N2CCN(C3CC3)CC2)CCCNC1.
What is the InChIKey of (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone?
The InChIKey is QQVFQRCKTPSABC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-14(5-2-6-15-11-14)13(18)17-9-7-16(8-10-17)12-3-4-12/h12,15H,2-11H2,1H3.
What are the key properties of (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone?
(4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone has a molecular weight of 251.37 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropylpiperazin-1-yl)-(3-methylpiperidin-3-yl)methanone is sourced from PubChem (CID 63131559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).