(3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine

C11H18N4 — CID 97162191

IUPAC(3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine
SMILESC[C@H](N[C@@H]1CCCNC1)c1cnccn1
InChIInChI=1S/C11H18N4/c1-9(11-8-13-5-6-14-11)15-10-3-2-4-12-7-10/h5-6,8-10,12,15H,2-4,7H2,1H3/t9-,10+/m0/s1
InChIKeyZPHCZTCPPNNFLH-VHSXEESVSA-N
MW206.29 g/mol
LogP0.88
Rot. Bonds3

About (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine

(3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine (PubChem CID 97162191) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine
PubChem CID97162191
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name(3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine
SMILESC[C@H](N[C@@H]1CCCNC1)c1cnccn1
InChIInChI=1S/C11H18N4/c1-9(11-8-13-5-6-14-11)15-10-3-2-4-12-7-10/h5-6,8-10,12,15H,2-4,7H2,1H3/t9-,10+/m0/s1
InChIKeyZPHCZTCPPNNFLH-VHSXEESVSA-N
XLogP0.88
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-N-(1-pyrazin-2-ylethyl)pyrrolidin-3-amine
CID 71637669
(3S)-N-(1-pyrazin-2-ylethyl)pyrrolidin-3-amine;hydrochloride
CID 71637668
(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine
CID 71637655
(3R)-N-(1-pyridin-2-ylethyl)piperidin-3-amine;hydrochloride
CID 71637625
(1S)-N-[(3S)-piperidin-3-yl]-1-pyrazin-2-ylethanesulfonamide
CID 97162097
3-cyclopropyl-N-(1-pyrazin-2-ylethyl)cyclohexan-1-amine
CID 75482982
3-methyl-N-(1-pyrazin-2-ylethyl)cyclopentan-1-amine
CID 114543875
2-[fluoro(piperidin-3-yl)methyl]pyrazine
CID 112565423
(3S)-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 71637667
2-(1-pyrazin-2-ylethylamino)cycloheptan-1-ol
CID 113394642
1-pyrazin-2-yl-N-pyrrolidin-3-ylethanesulfonamide;hydrochloride
CID 71637485
N-(1-pyridin-3-ylethyl)pyrrolidin-3-amine
CID 79724749

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine?
The IUPAC name of (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine (CID 97162191) is (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine.
What is the SMILES notation for (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine?
The canonical SMILES for (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine is C[C@H](N[C@@H]1CCCNC1)c1cnccn1.
What is the InChIKey of (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine?
The InChIKey is ZPHCZTCPPNNFLH-VHSXEESVSA-N. The full InChI is InChI=1S/C11H18N4/c1-9(11-8-13-5-6-14-11)15-10-3-2-4-12-7-10/h5-6,8-10,12,15H,2-4,7H2,1H3/t9-,10+/m0/s1.
What are the key properties of (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine?
(3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine has a molecular weight of 206.29 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine is sourced from PubChem (CID 97162191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).